N-(4-methylphenyl)-2-(2-phenylethanoylamino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

Systemtic Name: N-(4-methylphenyl)-2-(2-phenylethanoylamino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Openeye Name: 2-[(2-phenylacetyl)amino]-N-(p-tolyl)-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide CAS Name: N-(4-methylphenyl)-2-[(1-oxo-2-phenylethyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide IUPAC Name: N-(4-methylphenyl)-2-[(2-phenylacetyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Traditional Name: 2-[(2-phenylacetyl)amino]-N-(p-tolyl)-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide Formula: C24H24N2O2S MolecularWeight: 404.52456

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)C2=C(SC3=C2CCCC3)NC(=O)CC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)C2=C(SC3=C2CCCC3)NC(=O)CC4=CC=CC=C4

InChI

InChI=1S/C24H24N2O2S/c1-16-11-13-18(14-12-16)25-23(28)22-19-9-5-6-10-20(19)29-24(22)26-21(27)15-17-7-3-2-4-8-17/h2-4,7-8,11-14H,5-6,9-10,15H2,1H3,(H,25,28)(H,26,27)