3-chloranyl-N-[(2S)-2-(dimethylamino)-2-(4-methylphenyl)ethyl]-6-methyl-1-benzothiophene-2-carboxamide

Systemtic Name: 3-chloranyl-N-[(2S)-2-(dimethylamino)-2-(4-methylphenyl)ethyl]-6-methyl-1-benzothiophene-2-carboxamide Openeye Name: 3-chloro-N-[(2S)-2-(dimethylamino)-2-(p-tolyl)ethyl]-6-methyl-benzothiophene-2-carboxamide CAS Name: 3-chloro-N-[(2S)-2-(dimethylamino)-2-(4-methylphenyl)ethyl]-6-methyl-1-benzothiophene-2-carboxamide IUPAC Name: 3-chloro-N-[(2S)-2-(dimethylamino)-2-(4-methylphenyl)ethyl]-6-methyl-1-benzothiophene-2-carboxamide Traditional Name: 3-chloro-N-[(2S)-2-(dimethylamino)-2-(p-tolyl)ethyl]-6-methyl-benzothiophene-2-carboxamide Formula: C21H23ClN2OS MolecularWeight: 386.93812

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(CNC(=O)C2=C(C3=C(S2)C=C(C=C3)C)Cl)N(C)C

Isomeric SMILES

CC1=CC=C(C=C1)[C@@H](CNC(=O)C2=C(C3=C(S2)C=C(C=C3)C)Cl)N(C)C

InChI

InChI=1S/C21H23ClN2OS/c1-13-5-8-15(9-6-13)17(24(3)4)12-23-21(25)20-19(22)16-10-7-14(2)11-18(16)26-20/h5-11,17H,12H2,1-4H3,(H,23,25)/t17-/m1/s1