N2,N5-bis[5-[(3-azanyl-3-azanylidene-propyl)carbamoyl]-1-(cyclopropylmethyl)pyrrol-3-yl]pyridine-2,5-dicarboxamide

Systemtic Name: N2,N5-bis[5-[(3-azanyl-3-azanylidene-propyl)carbamoyl]-1-(cyclopropylmethyl)pyrrol-3-yl]pyridine-2,5-dicarboxamide Openeye Name: N2,N5-bis[5-[(3-amino-3-imino-propyl)carbamoyl]-1-(cyclopropylmethyl)pyrrol-3-yl]pyridine-2,5-dicarboxamide CAS Name: N2,N5-bis[5-[[(3-amino-3-iminopropyl)amino]-oxomethyl]-1-(cyclopropylmethyl)-3-pyrrolyl]pyridine-2,5-dicarboxamide IUPAC Name: 2-N,5-N-bis[5-[(3-amino-3-iminopropyl)carbamoyl]-1-(cyclopropylmethyl)pyrrol-3-yl]pyridine-2,5-dicarboxamide Traditional Name: N,N'-bis[5-[(3-amino-3-imino-propyl)carbamoyl]-1-(cyclopropylmethyl)pyrrol-3-yl]isocinchomeronamide Formula: C31H39N11O4 MolecularWeight: 629.71266

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1CN2C=C(C=C2C(=O)NCCC(=N)N)NC(=O)C3=CN=C(C=C3)C(=O)NC4=CN(C(=C4)C(=O)NCCC(=N)N)CC5CC5

Isomeric SMILES

C1CC1CN2C=C(C=C2C(=O)NCCC(=N)N)NC(=O)C3=CN=C(C=C3)C(=O)NC4=CN(C(=C4)C(=O)NCCC(=N)N)CC5CC5

InChI

InChI=1S/C31H39N11O4/c32-26(33)7-9-36-30(45)24-11-21(16-41(24)14-18-1-2-18)39-28(43)20-5-6-23(38-13-20)29(44)40-22-12-25(31(46)37-10-8-27(34)35)42(17-22)15-19-3-4-19/h5-6,11-13,16-19H,1-4,7-10,14-15H2,(H3,32,33)(H3,34,35)(H,36,45)(H,37,46)(H,39,43)(H,40,44)