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

Systemtic Name: propyl 2-[[6-bromanyl-2-(3-ethoxyphenyl)quinolin-4-yl]carbonylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate Openeye Name: propyl 2-[[6-bromo-2-(3-ethoxyphenyl)quinoline-4-carbonyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate CAS Name: 2-[[[6-bromo-2-(3-ethoxyphenyl)-4-quinolinyl]-oxomethyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylic acid propyl ester IUPAC Name: propyl 2-[[6-bromo-2-(3-ethoxyphenyl)quinoline-4-carbonyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate Traditional Name: 2-[(6-bromo-2-m-phenetyl-quinoline-4-carbonyl)amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylic acid propyl ester Formula: C29H27BrN2O4S MolecularWeight: 579.50468

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=C(SC2=C1CCC2)NC(=O)C3=CC(=NC4=C3C=C(C=C4)Br)C5=CC(=CC=C5)OCC

Isomeric SMILES

CCCOC(=O)C1=C(SC2=C1CCC2)NC(=O)C3=CC(=NC4=C3C=C(C=C4)Br)C5=CC(=CC=C5)OCC

InChI

InChI=1S/C29H27BrN2O4S/c1-3-13-36-29(34)26-20-9-6-10-25(20)37-28(26)32-27(33)22-16-24(17-7-5-8-19(14-17)35-4-2)31-23-12-11-18(30)15-21(22)23/h5,7-8,11-12,14-16H,3-4,6,9-10,13H2,1-2H3,(H,32,33)