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

Systemtic Name: N-(2,4-dimethylphenyl)-2-(2,2-dimethylpropanoylamino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Openeye Name: N-(2,4-dimethylphenyl)-2-(2,2-dimethylpropanoylamino)-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide CAS Name: 2-[(2,2-dimethyl-1-oxopropyl)amino]-N-(2,4-dimethylphenyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide IUPAC Name: N-(2,4-dimethylphenyl)-2-(2,2-dimethylpropanoylamino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Traditional Name: N-(2,4-dimethylphenyl)-2-(pivaloylamino)-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide Formula: C22H28N2O2S MolecularWeight: 384.53492

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)C2=C(SC3=C2CCCC3)NC(=O)C(C)(C)C)C

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)C2=C(SC3=C2CCCC3)NC(=O)C(C)(C)C)C

InChI

InChI=1S/C22H28N2O2S/c1-13-10-11-16(14(2)12-13)23-19(25)18-15-8-6-7-9-17(15)27-20(18)24-21(26)22(3,4)5/h10-12H,6-9H2,1-5H3,(H,23,25)(H,24,26)