N1,N4-bis[5-[(3-azanyl-3-azanylidene-propyl)carbamoyl]-1-(cyclopropylmethyl)pyrrol-3-yl]benzene-1,4-dicarboxamide

Systemtic Name: N1,N4-bis[5-[(3-azanyl-3-azanylidene-propyl)carbamoyl]-1-(cyclopropylmethyl)pyrrol-3-yl]benzene-1,4-dicarboxamide Openeye Name: N1,N4-bis[5-[(3-amino-3-imino-propyl)carbamoyl]-1-(cyclopropylmethyl)pyrrol-3-yl]terephthalamide CAS Name: N1,N4-bis[5-[[(3-amino-3-iminopropyl)amino]-oxomethyl]-1-(cyclopropylmethyl)-3-pyrrolyl]benzene-1,4-dicarboxamide IUPAC Name: 1-N,4-N-bis[5-[(3-amino-3-iminopropyl)carbamoyl]-1-(cyclopropylmethyl)pyrrol-3-yl]benzene-1,4-dicarboxamide Traditional Name: N,N'-bis[5-[(3-amino-3-imino-propyl)carbamoyl]-1-(cyclopropylmethyl)pyrrol-3-yl]terephthalamide Formula: C32H40N10O4 MolecularWeight: 628.7246

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Descriptors Computed from Structure

Canonical SMILES:

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

InChI

InChI=1S/C32H40N10O4/c33-27(34)9-11-37-31(45)25-13-23(17-41(25)15-19-1-2-19)39-29(43)21-5-7-22(8-6-21)30(44)40-24-14-26(32(46)38-12-10-28(35)36)42(18-24)16-20-3-4-20/h5-8,13-14,17-20H,1-4,9-12,15-16H2,(H3,33,34)(H3,35,36)(H,37,45)(H,38,46)(H,39,43)(H,40,44)