N-(2,6-dimethylphenyl)-2-[1-(phenylsulfonyl)benzimidazol-2-yl]sulfanyl-ethanamide

Systemtic Name: N-(2,6-dimethylphenyl)-2-[1-(phenylsulfonyl)benzimidazol-2-yl]sulfanyl-ethanamide Openeye Name: 2-[1-(benzenesulfonyl)benzimidazol-2-yl]sulfanyl-N-(2,6-dimethylphenyl)acetamide CAS Name: 2-[[1-(benzenesulfonyl)-2-benzimidazolyl]thio]-N-(2,6-dimethylphenyl)acetamide IUPAC Name: 2-[1-(benzenesulfonyl)benzimidazol-2-yl]sulfanyl-N-(2,6-dimethylphenyl)acetamide Traditional Name: 2-[(1-besylbenzimidazol-2-yl)thio]-N-(2,6-dimethylphenyl)acetamide Formula: C23H21N3O3S2 MolecularWeight: 451.56114

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(=O)CSC2=NC3=CC=CC=C3N2S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=O)CSC2=NC3=CC=CC=C3N2S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C23H21N3O3S2/c1-16-9-8-10-17(2)22(16)25-21(27)15-30-23-24-19-13-6-7-14-20(19)26(23)31(28,29)18-11-4-3-5-12-18/h3-14H,15H2,1-2H3,(H,25,27)