ethyl 2-[(8-chloranyl-2-pyridin-3-yl-quinolin-4-yl)carbonylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate

Systemtic Name: ethyl 2-[(8-chloranyl-2-pyridin-3-yl-quinolin-4-yl)carbonylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate Openeye Name: ethyl 2-[[8-chloro-2-(3-pyridyl)quinoline-4-carbonyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate CAS Name: 2-[[[8-chloro-2-(3-pyridinyl)-4-quinolinyl]-oxomethyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2-[(8-chloro-2-pyridin-3-ylquinoline-4-carbonyl)amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate Traditional Name: 2-[[8-chloro-2-(3-pyridyl)quinoline-4-carbonyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylic acid ethyl ester Formula: C25H20ClN3O3S MolecularWeight: 477.9626

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC2=C1CCC2)NC(=O)C3=CC(=NC4=C3C=CC=C4Cl)C5=CN=CC=C5

Isomeric SMILES

CCOC(=O)C1=C(SC2=C1CCC2)NC(=O)C3=CC(=NC4=C3C=CC=C4Cl)C5=CN=CC=C5

InChI

InChI=1S/C25H20ClN3O3S/c1-2-32-25(31)21-16-8-4-10-20(16)33-24(21)29-23(30)17-12-19(14-6-5-11-27-13-14)28-22-15(17)7-3-9-18(22)26/h3,5-7,9,11-13H,2,4,8,10H2,1H3,(H,29,30)