2-[[6-chloranyl-1-(2-hydroxyethyl)benzimidazol-2-yl]methylsulfanyl]-N-(3,4-dimethylphenyl)ethanamide

Systemtic Name: 2-[[6-chloranyl-1-(2-hydroxyethyl)benzimidazol-2-yl]methylsulfanyl]-N-(3,4-dimethylphenyl)ethanamide Openeye Name: 2-[[6-chloro-1-(2-hydroxyethyl)benzimidazol-2-yl]methylsulfanyl]-N-(3,4-dimethylphenyl)acetamide CAS Name: 2-[[6-chloro-1-(2-hydroxyethyl)-2-benzimidazolyl]methylthio]-N-(3,4-dimethylphenyl)acetamide IUPAC Name: 2-[[6-chloro-1-(2-hydroxyethyl)benzimidazol-2-yl]methylsulfanyl]-N-(3,4-dimethylphenyl)acetamide Traditional Name: 2-[[6-chloro-1-(2-hydroxyethyl)benzimidazol-2-yl]methylthio]-N-(3,4-dimethylphenyl)acetamide Formula: C20H22ClN3O2S MolecularWeight: 403.92558

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)CSCC2=NC3=C(N2CCO)C=C(C=C3)Cl)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)CSCC2=NC3=C(N2CCO)C=C(C=C3)Cl)C

InChI

InChI=1S/C20H22ClN3O2S/c1-13-3-5-16(9-14(13)2)22-20(26)12-27-11-19-23-17-6-4-15(21)10-18(17)24(19)7-8-25/h3-6,9-10,25H,7-8,11-12H2,1-2H3,(H,22,26)