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

Systemtic Name: propan-2-yl 2-[(6-bromanyl-2-pyridin-4-yl-quinolin-4-yl)carbonylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate Openeye Name: isopropyl 2-[[6-bromo-2-(4-pyridyl)quinoline-4-carbonyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate CAS Name: 2-[[(6-bromo-2-pyridin-4-yl-4-quinolinyl)-oxomethyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 2-[(6-bromo-2-pyridin-4-ylquinoline-4-carbonyl)amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate Traditional Name: 2-[[6-bromo-2-(4-pyridyl)quinoline-4-carbonyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylic acid isopropyl ester Formula: C26H22BrN3O3S MolecularWeight: 536.44018

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H22BrN3O3S/c1-14(2)33-26(32)23-17-4-3-5-22(17)34-25(23)30-24(31)19-13-21(15-8-10-28-11-9-15)29-20-7-6-16(27)12-18(19)20/h6-14H,3-5H2,1-2H3,(H,30,31)