N-(4-chlorophenyl)-2-(2,2-dimethylpropanoylamino)-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

Systemtic Name: N-(4-chlorophenyl)-2-(2,2-dimethylpropanoylamino)-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Openeye Name: N-(4-chlorophenyl)-2-(2,2-dimethylpropanoylamino)-6-methyl-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide CAS Name: N-(4-chlorophenyl)-2-[(2,2-dimethyl-1-oxopropyl)amino]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide IUPAC Name: N-(4-chlorophenyl)-2-(2,2-dimethylpropanoylamino)-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Traditional Name: N-(4-chlorophenyl)-6-methyl-2-(pivaloylamino)-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide Formula: C21H25ClN2O2S MolecularWeight: 404.9534

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)SC(=C2C(=O)NC3=CC=C(C=C3)Cl)NC(=O)C(C)(C)C

Isomeric SMILES

CC1CCC2=C(C1)SC(=C2C(=O)NC3=CC=C(C=C3)Cl)NC(=O)C(C)(C)C

InChI

InChI=1S/C21H25ClN2O2S/c1-12-5-10-15-16(11-12)27-19(24-20(26)21(2,3)4)17(15)18(25)23-14-8-6-13(22)7-9-14/h6-9,12H,5,10-11H2,1-4H3,(H,23,25)(H,24,26)