N3,N5-bis[5-[(3-azanyl-3-azanylidene-propyl)carbamoyl]-1-(cyclopropylmethyl)pyrrol-3-yl]-1H-pyrazole-3,5-dicarboxamide

Systemtic Name: N3,N5-bis[5-[(3-azanyl-3-azanylidene-propyl)carbamoyl]-1-(cyclopropylmethyl)pyrrol-3-yl]-1H-pyrazole-3,5-dicarboxamide Openeye Name: N3,N5-bis[5-[(3-amino-3-imino-propyl)carbamoyl]-1-(cyclopropylmethyl)pyrrol-3-yl]-1H-pyrazole-3,5-dicarboxamide CAS Name: N3,N5-bis[5-[[(3-amino-3-iminopropyl)amino]-oxomethyl]-1-(cyclopropylmethyl)-3-pyrrolyl]-1H-pyrazole-3,5-dicarboxamide IUPAC Name: 3-N,5-N-bis[5-[(3-amino-3-iminopropyl)carbamoyl]-1-(cyclopropylmethyl)pyrrol-3-yl]-1H-pyrazole-3,5-dicarboxamide Traditional Name: N,N'-bis[5-[(3-amino-3-imino-propyl)carbamoyl]-1-(cyclopropylmethyl)pyrrol-3-yl]-1H-pyrazole-3,5-dicarboxamide Formula: C29H38N12O4 MolecularWeight: 618.69002

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1CN2C=C(C=C2C(=O)NCCC(=N)N)NC(=O)C3=CC(=NN3)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(=NN3)C(=O)NC4=CN(C(=C4)C(=O)NCCC(=N)N)CC5CC5

InChI

InChI=1S/C29H38N12O4/c30-24(31)5-7-34-28(44)22-9-18(14-40(22)12-16-1-2-16)36-26(42)20-11-21(39-38-20)27(43)37-19-10-23(29(45)35-8-6-25(32)33)41(15-19)13-17-3-4-17/h9-11,14-17H,1-8,12-13H2,(H3,30,31)(H3,32,33)(H,34,44)(H,35,45)(H,36,42)(H,37,43)(H,38,39)