(2-chloranyl-7-methylsulfanyl-quinolin-3-yl)methyl 4-oxidanylidene-4-thiophen-2-yl-butanoate

Systemtic Name: (2-chloranyl-7-methylsulfanyl-quinolin-3-yl)methyl 4-oxidanylidene-4-thiophen-2-yl-butanoate Openeye Name: (2-chloro-7-methylsulfanyl-3-quinolyl)methyl 4-oxo-4-(2-thienyl)butanoate CAS Name: 4-oxo-4-thiophen-2-ylbutanoic acid [2-chloro-7-(methylthio)-3-quinolinyl]methyl ester IUPAC Name: (2-chloro-7-methylsulfanylquinolin-3-yl)methyl 4-oxo-4-thiophen-2-ylbutanoate Traditional Name: 4-keto-4-(2-thienyl)butyric acid [2-chloro-7-(methylthio)-3-quinolyl]methyl ester Formula: C19H16ClNO3S2 MolecularWeight: 405.91824

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC2=NC(=C(C=C2C=C1)COC(=O)CCC(=O)C3=CC=CS3)Cl

Isomeric SMILES

CSC1=CC2=NC(=C(C=C2C=C1)COC(=O)CCC(=O)C3=CC=CS3)Cl

InChI

InChI=1S/C19H16ClNO3S2/c1-25-14-5-4-12-9-13(19(20)21-15(12)10-14)11-24-18(23)7-6-16(22)17-3-2-8-26-17/h2-5,8-10H,6-7,11H2,1H3