ethyl 2-[[2-(3-cyclopentylpropanoyloxy)-2-phenyl-ethanoyl]amino]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Systemtic Name: ethyl 2-[[2-(3-cyclopentylpropanoyloxy)-2-phenyl-ethanoyl]amino]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Openeye Name: ethyl 2-[[2-(3-cyclopentylpropanoyloxy)-2-phenyl-acetyl]amino]-6-methyl-4,5,6,7-tetrahydrobenzothiophene-3-carboxylate CAS Name: 2-[[2-(3-cyclopentyl-1-oxopropoxy)-1-oxo-2-phenylethyl]amino]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-(3-cyclopentylpropanoyloxy)-2-phenylacetyl]amino]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Traditional Name: 2-[[2-(3-cyclopentylpropanoyloxy)-2-phenyl-acetyl]amino]-6-methyl-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic acid ethyl ester Formula: C28H35NO5S MolecularWeight: 497.6462

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC2=C1CCC(C2)C)NC(=O)C(C3=CC=CC=C3)OC(=O)CCC4CCCC4

Isomeric SMILES

CCOC(=O)C1=C(SC2=C1CCC(C2)C)NC(=O)C(C3=CC=CC=C3)OC(=O)CCC4CCCC4

InChI

InChI=1S/C28H35NO5S/c1-3-33-28(32)24-21-15-13-18(2)17-22(21)35-27(24)29-26(31)25(20-11-5-4-6-12-20)34-23(30)16-14-19-9-7-8-10-19/h4-6,11-12,18-19,25H,3,7-10,13-17H2,1-2H3,(H,29,31)