ethyl 2-[(7-chloranyl-8-methyl-2-pyridin-2-yl-quinolin-4-yl)carbonylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate

Systemtic Name: ethyl 2-[(7-chloranyl-8-methyl-2-pyridin-2-yl-quinolin-4-yl)carbonylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate Openeye Name: ethyl 2-[[7-chloro-8-methyl-2-(2-pyridyl)quinoline-4-carbonyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate CAS Name: 2-[[[7-chloro-8-methyl-2-(2-pyridinyl)-4-quinolinyl]-oxomethyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2-[(7-chloro-8-methyl-2-pyridin-2-ylquinoline-4-carbonyl)amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate Traditional Name: 2-[[7-chloro-8-methyl-2-(2-pyridyl)quinoline-4-carbonyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylic acid ethyl ester Formula: C26H22ClN3O3S MolecularWeight: 491.98918

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC2=C1CCC2)NC(=O)C3=CC(=NC4=C3C=CC(=C4C)Cl)C5=CC=CC=N5

Isomeric SMILES

CCOC(=O)C1=C(SC2=C1CCC2)NC(=O)C3=CC(=NC4=C3C=CC(=C4C)Cl)C5=CC=CC=N5

InChI

InChI=1S/C26H22ClN3O3S/c1-3-33-26(32)22-16-7-6-9-21(16)34-25(22)30-24(31)17-13-20(19-8-4-5-12-28-19)29-23-14(2)18(27)11-10-15(17)23/h4-5,8,10-13H,3,6-7,9H2,1-2H3,(H,30,31)