[4-(benzimidazol-1-yl)phenyl]-[4-(4-methoxy-3-nitro-phenyl)sulfonylpiperazin-1-yl]methanone

Systemtic Name: [4-(benzimidazol-1-yl)phenyl]-[4-(4-methoxy-3-nitro-phenyl)sulfonylpiperazin-1-yl]methanone Openeye Name: [4-(benzimidazol-1-yl)phenyl]-[4-(4-methoxy-3-nitro-phenyl)sulfonylpiperazin-1-yl]methanone CAS Name: [4-(1-benzimidazolyl)phenyl]-[4-(4-methoxy-3-nitrophenyl)sulfonyl-1-piperazinyl]methanone IUPAC Name: [4-(benzimidazol-1-yl)phenyl]-[4-(4-methoxy-3-nitrophenyl)sulfonylpiperazin-1-yl]methanone Traditional Name: [4-(benzimidazol-1-yl)phenyl]-[4-(4-methoxy-3-nitro-phenyl)sulfonylpiperazino]methanone Formula: C25H23N5O6S MolecularWeight: 521.54502

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC=C(C=C3)N4C=NC5=CC=CC=C54)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC=C(C=C3)N4C=NC5=CC=CC=C54)[N+](=O)[O-]

InChI

InChI=1S/C25H23N5O6S/c1-36-24-11-10-20(16-23(24)30(32)33)37(34,35)28-14-12-27(13-15-28)25(31)18-6-8-19(9-7-18)29-17-26-21-4-2-3-5-22(21)29/h2-11,16-17H,12-15H2,1H3