N-[(3Z)-3-azanyl-3-hydroxyimino-propyl]-4-[[4-[[4-[(2-chloroethylamino)-(4-ethylphenyl)carbonyl-amino]-1-methyl-pyrrol-2-yl]carbonylamino]-1-methyl-pyrrol-2-yl]carbonylamino]-1-methyl-pyrrole-2-carboxamide

Systemtic Name: N-[(3Z)-3-azanyl-3-hydroxyimino-propyl]-4-[[4-[[4-[(2-chloroethylamino)-(4-ethylphenyl)carbonyl-amino]-1-methyl-pyrrol-2-yl]carbonylamino]-1-methyl-pyrrol-2-yl]carbonylamino]-1-methyl-pyrrole-2-carboxamide Openeye Name: N-[(3Z)-3-amino-3-hydroxyimino-propyl]-4-[[4-[[4-[(2-chloroethylamino)-(4-ethylbenzoyl)amino]-1-methyl-pyrrole-2-carbonyl]amino]-1-methyl-pyrrole-2-carbonyl]amino]-1-methyl-pyrrole-2-carboxamide CAS Name: N-[(3Z)-3-amino-3-hydroxyiminopropyl]-4-[[[4-[[[4-[(2-chloroethylamino)-[(4-ethylphenyl)-oxomethyl]amino]-1-methyl-2-pyrrolyl]-oxomethyl]amino]-1-methyl-2-pyrrolyl]-oxomethyl]amino]-1-methyl-2-pyrrolecarboxamide IUPAC Name: N-[(3Z)-3-amino-3-hydroxyiminopropyl]-4-[[4-[[4-[(2-chloroethylamino)-(4-ethylbenzoyl)amino]-1-methylpyrrole-2-carbonyl]amino]-1-methylpyrrole-2-carbonyl]amino]-1-methylpyrrole-2-carboxamide Traditional Name: N-[(3Z)-3-amino-3-hydroximino-propyl]-4-[[4-[[4-[(2-chloroethylamino)-(4-ethylbenzoyl)amino]-1-methyl-pyrrole-2-carbonyl]amino]-1-methyl-pyrrole-2-carbonyl]amino]-1-methyl-pyrrole-2-carboxamide Formula: C32H39ClN10O5 MolecularWeight: 679.16906

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=O)N(C2=CN(C(=C2)C(=O)NC3=CN(C(=C3)C(=O)NC4=CN(C(=C4)C(=O)NCCC(=NO)N)C)C)C)NCCCl

Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)N(C2=CN(C(=C2)C(=O)NC3=CN(C(=C3)C(=O)NC4=CN(C(=C4)C(=O)NCC/C(=N/O)/N)C)C)C)NCCCl

InChI

InChI=1S/C32H39ClN10O5/c1-5-20-6-8-21(9-7-20)32(47)43(36-13-11-33)24-16-27(42(4)19-24)31(46)38-23-15-26(41(3)18-23)30(45)37-22-14-25(40(2)17-22)29(44)35-12-10-28(34)39-48/h6-9,14-19,36,48H,5,10-13H2,1-4H3,(H2,34,39)(H,35,44)(H,37,45)(H,38,46)