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

Systemtic Name: N-(4-ethoxyphenyl)-6-methyl-2-(propanoylamino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Openeye Name: N-(4-ethoxyphenyl)-6-methyl-2-(propanoylamino)-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide CAS Name: N-(4-ethoxyphenyl)-6-methyl-2-(1-oxopropylamino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide IUPAC Name: N-(4-ethoxyphenyl)-6-methyl-2-(propanoylamino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Traditional Name: 6-methyl-N-p-phenetyl-2-propionamido-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide Formula: C21H26N2O3S MolecularWeight: 386.50774

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=C(C2=C(S1)CC(CC2)C)C(=O)NC3=CC=C(C=C3)OCC

Isomeric SMILES

CCC(=O)NC1=C(C2=C(S1)CC(CC2)C)C(=O)NC3=CC=C(C=C3)OCC

InChI

InChI=1S/C21H26N2O3S/c1-4-18(24)23-21-19(16-11-6-13(3)12-17(16)27-21)20(25)22-14-7-9-15(10-8-14)26-5-2/h7-10,13H,4-6,11-12H2,1-3H3,(H,22,25)(H,23,24)