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

Systemtic Name: N-(2,6-dimethylphenyl)-2-[1-(2-methylpropyl)benzimidazol-2-yl]sulfanyl-ethanamide Openeye Name: N-(2,6-dimethylphenyl)-2-(1-isobutylbenzimidazol-2-yl)sulfanyl-acetamide CAS Name: N-(2,6-dimethylphenyl)-2-[[1-(2-methylpropyl)-2-benzimidazolyl]thio]acetamide IUPAC Name: N-(2,6-dimethylphenyl)-2-[1-(2-methylpropyl)benzimidazol-2-yl]sulfanylacetamide Traditional Name: N-(2,6-dimethylphenyl)-2-[(1-isobutylbenzimidazol-2-yl)thio]acetamide Formula: C21H25N3OS MolecularWeight: 367.5077

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(=O)CSC2=NC3=CC=CC=C3N2CC(C)C

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=O)CSC2=NC3=CC=CC=C3N2CC(C)C

InChI

InChI=1S/C21H25N3OS/c1-14(2)12-24-18-11-6-5-10-17(18)22-21(24)26-13-19(25)23-20-15(3)8-7-9-16(20)4/h5-11,14H,12-13H2,1-4H3,(H,23,25)