2-methyl-3-[(4-nitrophenyl)methyl]-N-(phenylsulfonyl)benzimidazole-5-carboxamide

Systemtic Name: 2-methyl-3-[(4-nitrophenyl)methyl]-N-(phenylsulfonyl)benzimidazole-5-carboxamide Openeye Name: N-(benzenesulfonyl)-2-methyl-3-[(4-nitrophenyl)methyl]benzimidazole-5-carboxamide CAS Name: N-(benzenesulfonyl)-2-methyl-3-[(4-nitrophenyl)methyl]-5-benzimidazolecarboxamide IUPAC Name: N-(benzenesulfonyl)-2-methyl-3-[(4-nitrophenyl)methyl]benzimidazole-5-carboxamide Traditional Name: N-besyl-2-methyl-3-(4-nitrobenzyl)benzimidazole-5-carboxamide Formula: C22H18N4O5S MolecularWeight: 450.46712

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(N1CC3=CC=C(C=C3)[N+](=O)[O-])C=C(C=C2)C(=O)NS(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

CC1=NC2=C(N1CC3=CC=C(C=C3)[N+](=O)[O-])C=C(C=C2)C(=O)NS(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C22H18N4O5S/c1-15-23-20-12-9-17(22(27)24-32(30,31)19-5-3-2-4-6-19)13-21(20)25(15)14-16-7-10-18(11-8-16)26(28)29/h2-13H,14H2,1H3,(H,24,27)