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

Systemtic Name: 2-(2,2-dimethylpropanoylamino)-N-(4-ethoxyphenyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Openeye Name: 2-(2,2-dimethylpropanoylamino)-N-(4-ethoxyphenyl)-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide CAS Name: 2-[(2,2-dimethyl-1-oxopropyl)amino]-N-(4-ethoxyphenyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide IUPAC Name: 2-(2,2-dimethylpropanoylamino)-N-(4-ethoxyphenyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Traditional Name: 2-(pivaloylamino)-N-p-phenetyl-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide Formula: C22H28N2O3S MolecularWeight: 400.53432

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=O)C2=C(SC3=C2CCCC3)NC(=O)C(C)(C)C

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=O)C2=C(SC3=C2CCCC3)NC(=O)C(C)(C)C

InChI

InChI=1S/C22H28N2O3S/c1-5-27-15-12-10-14(11-13-15)23-19(25)18-16-8-6-7-9-17(16)28-20(18)24-21(26)22(2,3)4/h10-13H,5-9H2,1-4H3,(H,23,25)(H,24,26)