4-[(2-butylbenzimidazol-1-yl)methyl]-3-nitro-N-(phenylsulfonyl)benzamide

Systemtic Name: 4-[(2-butylbenzimidazol-1-yl)methyl]-3-nitro-N-(phenylsulfonyl)benzamide Openeye Name: N-(benzenesulfonyl)-4-[(2-butylbenzimidazol-1-yl)methyl]-3-nitro-benzamide CAS Name: N-(benzenesulfonyl)-4-[(2-butyl-1-benzimidazolyl)methyl]-3-nitrobenzamide IUPAC Name: N-(benzenesulfonyl)-4-[(2-butylbenzimidazol-1-yl)methyl]-3-nitrobenzamide Traditional Name: N-besyl-4-[(2-butylbenzimidazol-1-yl)methyl]-3-nitro-benzamide Formula: C25H24N4O5S MolecularWeight: 492.54686

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC2=CC=CC=C2N1CC3=C(C=C(C=C3)C(=O)NS(=O)(=O)C4=CC=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CCCCC1=NC2=CC=CC=C2N1CC3=C(C=C(C=C3)C(=O)NS(=O)(=O)C4=CC=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C25H24N4O5S/c1-2-3-13-24-26-21-11-7-8-12-22(21)28(24)17-19-15-14-18(16-23(19)29(31)32)25(30)27-35(33,34)20-9-5-4-6-10-20/h4-12,14-16H,2-3,13,17H2,1H3,(H,27,30)