ethyl 1-(2-aminophenyl)-2-methylsulfanyl-4-oxidanylidene-7-pyridin-4-yl-quinoline-3-carboxylate

Systemtic Name: ethyl 1-(2-aminophenyl)-2-methylsulfanyl-4-oxidanylidene-7-pyridin-4-yl-quinoline-3-carboxylate Openeye Name: ethyl 1-(2-aminophenyl)-2-methylsulfanyl-4-oxo-7-(4-pyridyl)quinoline-3-carboxylate CAS Name: 1-(2-aminophenyl)-2-(methylthio)-4-oxo-7-pyridin-4-yl-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(2-aminophenyl)-2-methylsulfanyl-4-oxo-7-pyridin-4-ylquinoline-3-carboxylate Traditional Name: 1-(2-aminophenyl)-4-keto-2-(methylthio)-7-(4-pyridyl)quinoline-3-carboxylic acid ethyl ester Formula: C24H21N3O3S MolecularWeight: 431.50684

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C2=C(C1=O)C=CC(=C2)C3=CC=NC=C3)C4=CC=CC=C4N)SC

Isomeric SMILES

CCOC(=O)C1=C(N(C2=C(C1=O)C=CC(=C2)C3=CC=NC=C3)C4=CC=CC=C4N)SC

InChI

InChI=1S/C24H21N3O3S/c1-3-30-24(29)21-22(28)17-9-8-16(15-10-12-26-13-11-15)14-20(17)27(23(21)31-2)19-7-5-4-6-18(19)25/h4-14H,3,25H2,1-2H3