ethyl 6-ethyl-2-[(3,6,8-trimethyl-2-phenyl-quinolin-4-yl)carbonylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Systemtic Name: ethyl 6-ethyl-2-[(3,6,8-trimethyl-2-phenyl-quinolin-4-yl)carbonylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Openeye Name: ethyl 6-ethyl-2-[(3,6,8-trimethyl-2-phenyl-quinoline-4-carbonyl)amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylate CAS Name: 6-ethyl-2-[[oxo-(3,6,8-trimethyl-2-phenyl-4-quinolinyl)methyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid ethyl ester IUPAC Name: ethyl 6-ethyl-2-[(3,6,8-trimethyl-2-phenylquinoline-4-carbonyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Traditional Name: 6-ethyl-2-[(3,6,8-trimethyl-2-phenyl-quinoline-4-carbonyl)amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic acid ethyl ester Formula: C32H34N2O3S MolecularWeight: 526.68896

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCC2=C(C1)SC(=C2C(=O)OCC)NC(=O)C3=C(C(=NC4=C(C=C(C=C34)C)C)C5=CC=CC=C5)C

Isomeric SMILES

CCC1CCC2=C(C1)SC(=C2C(=O)OCC)NC(=O)C3=C(C(=NC4=C(C=C(C=C34)C)C)C5=CC=CC=C5)C

InChI

InChI=1S/C32H34N2O3S/c1-6-21-13-14-23-25(17-21)38-31(27(23)32(36)37-7-2)34-30(35)26-20(5)29(22-11-9-8-10-12-22)33-28-19(4)15-18(3)16-24(26)28/h8-12,15-16,21H,6-7,13-14,17H2,1-5H3,(H,34,35)