propyl 2-[[2-(4-butan-2-ylphenyl)quinolin-4-yl]carbonylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate

Systemtic Name: propyl 2-[[2-(4-butan-2-ylphenyl)quinolin-4-yl]carbonylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate Openeye Name: propyl 2-[[2-(4-sec-butylphenyl)quinoline-4-carbonyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate CAS Name: 2-[[[2-(4-butan-2-ylphenyl)-4-quinolinyl]-oxomethyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylic acid propyl ester IUPAC Name: propyl 2-[[2-(4-butan-2-ylphenyl)quinoline-4-carbonyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate Traditional Name: 2-[[2-(4-sec-butylphenyl)quinoline-4-carbonyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylic acid propyl ester Formula: C31H32N2O3S MolecularWeight: 512.66238

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=C(SC2=C1CCC2)NC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=C(C=C5)C(C)CC

Isomeric SMILES

CCCOC(=O)C1=C(SC2=C1CCC2)NC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=C(C=C5)C(C)CC

InChI

InChI=1S/C31H32N2O3S/c1-4-17-36-31(35)28-23-10-8-12-27(23)37-30(28)33-29(34)24-18-26(32-25-11-7-6-9-22(24)25)21-15-13-20(14-16-21)19(3)5-2/h6-7,9,11,13-16,18-19H,4-5,8,10,12,17H2,1-3H3,(H,33,34)