methyl 6-(2-methylbutan-2-yl)-2-(2-naphthalen-2-yloxyethanoylamino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Systemtic Name: methyl 6-(2-methylbutan-2-yl)-2-(2-naphthalen-2-yloxyethanoylamino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Openeye Name: methyl 6-(1,1-dimethylpropyl)-2-[[2-(2-naphthyloxy)acetyl]amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylate CAS Name: 6-(2-methylbutan-2-yl)-2-[[2-(2-naphthalenyloxy)-1-oxoethyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid methyl ester IUPAC Name: methyl 6-(2-methylbutan-2-yl)-2-[(2-naphthalen-2-yloxyacetyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Traditional Name: 6-tert-amyl-2-[[2-(2-naphthoxy)acetyl]amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic acid methyl ester Formula: C27H31NO4S MolecularWeight: 465.60434

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C1CCC2=C(C1)SC(=C2C(=O)OC)NC(=O)COC3=CC4=CC=CC=C4C=C3

Isomeric SMILES

CCC(C)(C)C1CCC2=C(C1)SC(=C2C(=O)OC)NC(=O)COC3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C27H31NO4S/c1-5-27(2,3)19-11-13-21-22(15-19)33-25(24(21)26(30)31-4)28-23(29)16-32-20-12-10-17-8-6-7-9-18(17)14-20/h6-10,12,14,19H,5,11,13,15-16H2,1-4H3,(H,28,29)