methyl 1-(2-methylsulfanylpyridin-3-yl)carbonyl-3,4-dihydro-2H-quinoline-5-carboxylate

Systemtic Name: methyl 1-(2-methylsulfanylpyridin-3-yl)carbonyl-3,4-dihydro-2H-quinoline-5-carboxylate Openeye Name: methyl 1-(2-methylsulfanylpyridine-3-carbonyl)-3,4-dihydro-2H-quinoline-5-carboxylate CAS Name: 1-[[2-(methylthio)-3-pyridinyl]-oxomethyl]-3,4-dihydro-2H-quinoline-5-carboxylic acid methyl ester IUPAC Name: methyl 1-(2-methylsulfanylpyridine-3-carbonyl)-3,4-dihydro-2H-quinoline-5-carboxylate Traditional Name: 1-[2-(methylthio)nicotinoyl]-3,4-dihydro-2H-quinoline-5-carboxylic acid methyl ester Formula: C18H18N2O3S MolecularWeight: 342.41212

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C2CCCN(C2=CC=C1)C(=O)C3=C(N=CC=C3)SC

Isomeric SMILES

COC(=O)C1=C2CCCN(C2=CC=C1)C(=O)C3=C(N=CC=C3)SC

InChI

InChI=1S/C18H18N2O3S/c1-23-18(22)13-6-3-9-15-12(13)8-5-11-20(15)17(21)14-7-4-10-19-16(14)24-2/h3-4,6-7,9-10H,5,8,11H2,1-2H3