4-[[4-[3-(cyclopentylcarbonylamino)propanoylamino]-1-methyl-pyrrol-2-yl]carbonylamino]-N-[5-[3-(dimethylamino)propylcarbamoyl]-1-methyl-pyrrol-3-yl]-1-methyl-imidazole-2-carboxamide; N-[3-(cyclopentylcarbonylamino)propyl]-1-methyl-4-[[4-[(1-methylimidazol-2-yl)carbonylamino]-1H-pyrrol-2-yl]carbonylamino]imidazole-2-carboxamide; iron(2+)

Systemtic Name: 4-[[4-[3-(cyclopentylcarbonylamino)propanoylamino]-1-methyl-pyrrol-2-yl]carbonylamino]-N-[5-[3-(dimethylamino)propylcarbamoyl]-1-methyl-pyrrol-3-yl]-1-methyl-imidazole-2-carboxamide; N-[3-(cyclopentylcarbonylamino)propyl]-1-methyl-4-[[4-[(1-methylimidazol-2-yl)carbonylamino]-1H-pyrrol-2-yl]carbonylamino]imidazole-2-carboxamide; iron(2+) Openeye Name: ferrous; 4-[[4-[3-(cyclopentanecarbonylamino)propanoylamino]-1-methyl-pyrrole-2-carbonyl]amino]-N-[5-[3-(dimethylamino)propylcarbamoyl]-1-methyl-pyrrol-3-yl]-1-methyl-imidazole-2-carboxamide; N-[3-(cyclopentanecarbonylamino)propyl]-1-methyl-4-[[4-[(1-methylimidazole-2-carbonyl)amino]-1H-pyrrole-2-carbonyl]amino]imidazole-2-carboxamide CAS Name: 4-[[[4-[[3-[[cyclopentyl(oxo)methyl]amino]-1-oxopropyl]amino]-1-methyl-2-pyrrolyl]-oxomethyl]amino]-N-[5-[[3-(dimethylamino)propylamino]-oxomethyl]-1-methyl-3-pyrrolyl]-1-methyl-2-imidazolecarboxamide; N-[3-[[cyclopentyl(oxo)methyl]amino]propyl]-1-methyl-4-[[[4-[[(1-methyl-2-imidazolyl)-oxomethyl]amino]-1H-pyrrol-2-yl]-oxomethyl]amino]-2-imidazolecarboxamide; iron(2+) IUPAC Name: 4-[[4-[3-(cyclopentanecarbonylamino)propanoylamino]-1-methylpyrrole-2-carbonyl]amino]-N-[5-[3-(dimethylamino)propylcarbamoyl]-1-methylpyrrol-3-yl]-1-methylimidazole-2-carboxamide; N-[3-(cyclopentanecarbonylamino)propyl]-1-methyl-4-[[4-[(1-methylimidazole-2-carbonyl)amino]-1H-pyrrole-2-carbonyl]amino]imidazole-2-carboxamide; iron(2+) Traditional Name: ferrous; 4-[[4-[3-(cyclopentanecarbonylamino)propanoylamino]-1-methyl-pyrrole-2-carbonyl]amino]-N-[5-[3-(dimethylamino)propylcarbamoyl]-1-methyl-pyrrol-3-yl]-1-methyl-imidazole-2-carboxamide; N-[3-(cyclopentanecarbonylamino)propyl]-1-methyl-4-[[4-[(1-methylimidazole-2-carbonyl)amino]-1H-pyrrole-2-carbonyl]amino]imidazole-2-carboxamide Formula: C55H65FeN19O9+2 MolecularWeight: 1192.0715

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1C(=O)NC2=CNC(=C2)C(=O)NC3=CN(C(=N3)C(=O)NCCCNC(=O)[C]4[CH][CH][CH][CH]4)C.CN1C=C(C=C1C(=O)NC2=CN(C(=N2)C(=O)NC3=CN(C(=C3)C(=O)NCCCN(C)C)C)C)NC(=O)CCNC(=O)[C]4[CH][CH][CH][CH]4.[Fe+2]

Isomeric SMILES

CN1C=CN=C1C(=O)NC2=CNC(=C2)C(=O)NC3=CN(C(=N3)C(=O)NCCCNC(=O)[C]4[CH][CH][CH][CH]4)C.CN1C=C(C=C1C(=O)NC2=CN(C(=N2)C(=O)NC3=CN(C(=C3)C(=O)NCCCN(C)C)C)C)NC(=O)CCNC(=O)[C]4[CH][CH][CH][CH]4.[Fe+2]

InChI

InChI=1S/C31H39N10O5.C24H26N9O4.Fe/c1-38(2)14-8-12-32-29(44)23-16-22(18-39(23)3)35-31(46)27-36-25(19-41(27)5)37-30(45)24-15-21(17-40(24)4)34-26(42)11-13-33-28(43)20-9-6-7-10-20;1-32-11-10-25-19(32)24(37)29-16-12-17(28-13-16)22(35)31-18-14-33(2)20(30-18)23(36)27-9-5-8-26-21(34)15-6-3-4-7-15;/h6-7,9-10,15-19H,8,11-14H2,1-5H3,(H,32,44)(H,33,43)(H,34,42)(H,35,46)(H,37,45);3-4,6-7,10-14,28H,5,8-9H2,1-2H3,(H,26,34)(H,27,36)(H,29,37)(H,31,35);/q;;+2