N-(4-ethoxyphenyl)-2-[1-(2-methylpropyl)benzimidazol-2-yl]sulfanyl-ethanamide

Systemtic Name: N-(4-ethoxyphenyl)-2-[1-(2-methylpropyl)benzimidazol-2-yl]sulfanyl-ethanamide Openeye Name: N-(4-ethoxyphenyl)-2-(1-isobutylbenzimidazol-2-yl)sulfanyl-acetamide CAS Name: N-(4-ethoxyphenyl)-2-[[1-(2-methylpropyl)-2-benzimidazolyl]thio]acetamide IUPAC Name: N-(4-ethoxyphenyl)-2-[1-(2-methylpropyl)benzimidazol-2-yl]sulfanylacetamide Traditional Name: 2-[(1-isobutylbenzimidazol-2-yl)thio]-N-p-phenetyl-acetamide Formula: C21H25N3O2S MolecularWeight: 383.5071

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=O)CSC2=NC3=CC=CC=C3N2CC(C)C

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=O)CSC2=NC3=CC=CC=C3N2CC(C)C

InChI

InChI=1S/C21H25N3O2S/c1-4-26-17-11-9-16(10-12-17)22-20(25)14-27-21-23-18-7-5-6-8-19(18)24(21)13-15(2)3/h5-12,15H,4,13-14H2,1-3H3,(H,22,25)