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

Systemtic Name: N-[5-[(3-azanyl-3-azanylidene-propyl)carbamoyl]-1-methyl-pyrrol-3-yl]-4-[5-[[5-[[5-[2-[bis(azanyl)methylideneamino]ethanoylamino]-1-methyl-pyrrol-3-yl]carbonylamino]-1-methyl-pyrrol-3-yl]carbonylamino]pentanoylamino]-1-methyl-pyrrole-2-carboxamide Openeye Name: N-[5-[(3-amino-3-imino-propyl)carbamoyl]-1-methyl-pyrrol-3-yl]-4-[5-[[5-[[5-[(2-guanidinoacetyl)amino]-1-methyl-pyrrole-3-carbonyl]amino]-1-methyl-pyrrole-3-carbonyl]amino]pentanoylamino]-1-methyl-pyrrole-2-carboxamide CAS Name: N-[5-[[(3-amino-3-iminopropyl)amino]-oxomethyl]-1-methyl-3-pyrrolyl]-4-[[5-[[[5-[[[5-[[2-(diaminomethylideneamino)-1-oxoethyl]amino]-1-methyl-3-pyrrolyl]-oxomethyl]amino]-1-methyl-3-pyrrolyl]-oxomethyl]amino]-1-oxopentyl]amino]-1-methyl-2-pyrrolecarboxamide IUPAC Name: N-[5-[(3-amino-3-iminopropyl)carbamoyl]-1-methylpyrrol-3-yl]-4-[5-[[5-[[5-[[2-(diaminomethylideneamino)acetyl]amino]-1-methylpyrrole-3-carbonyl]amino]-1-methylpyrrole-3-carbonyl]amino]pentanoylamino]-1-methylpyrrole-2-carboxamide Traditional Name: N-[5-[(3-amino-3-imino-propyl)carbamoyl]-1-methyl-pyrrol-3-yl]-4-[5-[[5-[[5-[(2-guanidinoacetyl)amino]-1-methyl-pyrrole-3-carbonyl]amino]-1-methyl-pyrrole-3-carbonyl]amino]pentanoylamino]-1-methyl-pyrrole-2-carboxamide Formula: C35H47N15O6 MolecularWeight: 773.84458

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

InChI

InChI=1S/C35H47N15O6/c1-47-19-23(14-24(47)33(55)41-10-8-26(36)37)44-34(56)25-13-22(18-48(25)2)43-29(51)7-5-6-9-40-31(53)20-11-28(50(4)16-20)46-32(54)21-12-27(49(3)17-21)45-30(52)15-42-35(38)39/h11-14,16-19H,5-10,15H2,1-4H3,(H3,36,37)(H,40,53)(H,41,55)(H,43,51)(H,44,56)(H,45,52)(H,46,54)(H4,38,39,42)