N-[5-[(3-azanyl-3-azanylidene-propyl)carbamoyl]-1-methyl-pyrrol-3-yl]-4-[3-[[5-[[5-[2-[bis(azanyl)methylideneamino]ethanoylamino]-1-methyl-pyrrol-3-yl]carbonylamino]-1-methyl-pyrrol-3-yl]carbonylamino]propanoylamino]-1-methyl-pyrrole-2-carboxamide

Systemtic Name: N-[5-[(3-azanyl-3-azanylidene-propyl)carbamoyl]-1-methyl-pyrrol-3-yl]-4-[3-[[5-[[5-[2-[bis(azanyl)methylideneamino]ethanoylamino]-1-methyl-pyrrol-3-yl]carbonylamino]-1-methyl-pyrrol-3-yl]carbonylamino]propanoylamino]-1-methyl-pyrrole-2-carboxamide Openeye Name: N-[5-[(3-amino-3-imino-propyl)carbamoyl]-1-methyl-pyrrol-3-yl]-4-[3-[[5-[[5-[(2-guanidinoacetyl)amino]-1-methyl-pyrrole-3-carbonyl]amino]-1-methyl-pyrrole-3-carbonyl]amino]propanoylamino]-1-methyl-pyrrole-2-carboxamide CAS Name: N-[5-[[(3-amino-3-iminopropyl)amino]-oxomethyl]-1-methyl-3-pyrrolyl]-4-[[3-[[[5-[[[5-[[2-(diaminomethylideneamino)-1-oxoethyl]amino]-1-methyl-3-pyrrolyl]-oxomethyl]amino]-1-methyl-3-pyrrolyl]-oxomethyl]amino]-1-oxopropyl]amino]-1-methyl-2-pyrrolecarboxamide IUPAC Name: N-[5-[(3-amino-3-iminopropyl)carbamoyl]-1-methylpyrrol-3-yl]-4-[3-[[5-[[5-[[2-(diaminomethylideneamino)acetyl]amino]-1-methylpyrrole-3-carbonyl]amino]-1-methylpyrrole-3-carbonyl]amino]propanoylamino]-1-methylpyrrole-2-carboxamide Traditional Name: N-[5-[(3-amino-3-imino-propyl)carbamoyl]-1-methyl-pyrrol-3-yl]-4-[3-[[5-[[5-[(2-guanidinoacetyl)amino]-1-methyl-pyrrole-3-carbonyl]amino]-1-methyl-pyrrole-3-carbonyl]amino]propanoylamino]-1-methyl-pyrrole-2-carboxamide Formula: C33H43N15O6 MolecularWeight: 745.79142

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=C1C(=O)NC2=CN(C(=C2)C(=O)NCCC(=N)N)C)NC(=O)CCNC(=O)C3=CN(C(=C3)NC(=O)C4=CN(C(=C4)NC(=O)CN=C(N)N)C)C

Isomeric SMILES

CN1C=C(C=C1C(=O)NC2=CN(C(=C2)C(=O)NCCC(=N)N)C)NC(=O)CCNC(=O)C3=CN(C(=C3)NC(=O)C4=CN(C(=C4)NC(=O)CN=C(N)N)C)C

InChI

InChI=1S/C33H43N15O6/c1-45-17-21(12-22(45)31(53)39-7-5-24(34)35)42-32(54)23-11-20(16-46(23)2)41-27(49)6-8-38-29(51)18-9-26(48(4)14-18)44-30(52)19-10-25(47(3)15-19)43-28(50)13-40-33(36)37/h9-12,14-17H,5-8,13H2,1-4H3,(H3,34,35)(H,38,51)(H,39,53)(H,41,49)(H,42,54)(H,43,50)(H,44,52)(H4,36,37,40)