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

Systemtic Name: N2,N5-bis[5-[(3-azanyl-3-azanylidene-propyl)carbamoyl]-1-(cyclopropylmethyl)pyrrol-3-yl]thiophene-2,5-dicarboxamide Openeye Name: N2,N5-bis[5-[(3-amino-3-imino-propyl)carbamoyl]-1-(cyclopropylmethyl)pyrrol-3-yl]thiophene-2,5-dicarboxamide CAS Name: N2,N5-bis[5-[[(3-amino-3-iminopropyl)amino]-oxomethyl]-1-(cyclopropylmethyl)-3-pyrrolyl]thiophene-2,5-dicarboxamide IUPAC Name: 2-N,5-N-bis[5-[(3-amino-3-iminopropyl)carbamoyl]-1-(cyclopropylmethyl)pyrrol-3-yl]thiophene-2,5-dicarboxamide Traditional Name: N,N'-bis[5-[(3-amino-3-imino-propyl)carbamoyl]-1-(cyclopropylmethyl)pyrrol-3-yl]thiophene-2,5-dicarboxamide Formula: C30H38N10O4S MolecularWeight: 634.75232

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1CN2C=C(C=C2C(=O)NCCC(=N)N)NC(=O)C3=CC=C(S3)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(S3)C(=O)NC4=CN(C(=C4)C(=O)NCCC(=N)N)CC5CC5

InChI

InChI=1S/C30H38N10O4S/c31-25(32)7-9-35-27(41)21-11-19(15-39(21)13-17-1-2-17)37-29(43)23-5-6-24(45-23)30(44)38-20-12-22(28(42)36-10-8-26(33)34)40(16-20)14-18-3-4-18/h5-6,11-12,15-18H,1-4,7-10,13-14H2,(H3,31,32)(H3,33,34)(H,35,41)(H,36,42)(H,37,43)(H,38,44)