N-(3-chloranyl-4-methoxy-phenyl)-2-[2-(2-methylpropylsulfanyl)benzimidazol-1-yl]ethanamide

Systemtic Name: N-(3-chloranyl-4-methoxy-phenyl)-2-[2-(2-methylpropylsulfanyl)benzimidazol-1-yl]ethanamide Openeye Name: N-(3-chloro-4-methoxy-phenyl)-2-(2-isobutylsulfanylbenzimidazol-1-yl)acetamide CAS Name: N-(3-chloro-4-methoxyphenyl)-2-[2-(2-methylpropylthio)-1-benzimidazolyl]acetamide IUPAC Name: N-(3-chloro-4-methoxyphenyl)-2-[2-(2-methylpropylsulfanyl)benzimidazol-1-yl]acetamide Traditional Name: N-(3-chloro-4-methoxy-phenyl)-2-[2-(isobutylthio)benzimidazol-1-yl]acetamide Formula: C20H22ClN3O2S MolecularWeight: 403.92558

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CSC1=NC2=CC=CC=C2N1CC(=O)NC3=CC(=C(C=C3)OC)Cl

Isomeric SMILES

CC(C)CSC1=NC2=CC=CC=C2N1CC(=O)NC3=CC(=C(C=C3)OC)Cl

InChI

InChI=1S/C20H22ClN3O2S/c1-13(2)12-27-20-23-16-6-4-5-7-17(16)24(20)11-19(25)22-14-8-9-18(26-3)15(21)10-14/h4-10,13H,11-12H2,1-3H3,(H,22,25)