1-methyl-4-[4-[2-nitro-4-(phenylcarbonyl)phenyl]piperazin-1-yl]sulfonyl-pyrrole-2-carboxamide

Systemtic Name: 1-methyl-4-[4-[2-nitro-4-(phenylcarbonyl)phenyl]piperazin-1-yl]sulfonyl-pyrrole-2-carboxamide Openeye Name: 4-[4-(4-benzoyl-2-nitro-phenyl)piperazin-1-yl]sulfonyl-1-methyl-pyrrole-2-carboxamide CAS Name: 4-[[4-(4-benzoyl-2-nitrophenyl)-1-piperazinyl]sulfonyl]-1-methyl-2-pyrrolecarboxamide IUPAC Name: 4-[4-(4-benzoyl-2-nitrophenyl)piperazin-1-yl]sulfonyl-1-methylpyrrole-2-carboxamide Traditional Name: 4-[4-(4-benzoyl-2-nitro-phenyl)piperazino]sulfonyl-1-methyl-pyrrole-2-carboxamide Formula: C23H23N5O6S MolecularWeight: 497.52362

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=C1C(=O)N)S(=O)(=O)N2CCN(CC2)C3=C(C=C(C=C3)C(=O)C4=CC=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CN1C=C(C=C1C(=O)N)S(=O)(=O)N2CCN(CC2)C3=C(C=C(C=C3)C(=O)C4=CC=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C23H23N5O6S/c1-25-15-18(14-21(25)23(24)30)35(33,34)27-11-9-26(10-12-27)19-8-7-17(13-20(19)28(31)32)22(29)16-5-3-2-4-6-16/h2-8,13-15H,9-12H2,1H3,(H2,24,30)