methyl 2-[2-(diethylamino)-2-oxidanylidene-ethyl]sulfanyl-4-oxidanylidene-1H-quinoline-3-carboxylate

Systemtic Name: methyl 2-[2-(diethylamino)-2-oxidanylidene-ethyl]sulfanyl-4-oxidanylidene-1H-quinoline-3-carboxylate Openeye Name: methyl 2-[2-(diethylamino)-2-oxo-ethyl]sulfanyl-4-oxo-1H-quinoline-3-carboxylate CAS Name: 2-[[2-(diethylamino)-2-oxoethyl]thio]-4-oxo-1H-quinoline-3-carboxylic acid methyl ester IUPAC Name: methyl 2-[2-(diethylamino)-2-oxoethyl]sulfanyl-4-oxo-1H-quinoline-3-carboxylate Traditional Name: 2-[[2-(diethylamino)-2-keto-ethyl]thio]-4-keto-1H-quinoline-3-carboxylic acid methyl ester Formula: C17H20N2O4S MolecularWeight: 348.4167

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)CSC1=C(C(=O)C2=CC=CC=C2N1)C(=O)OC

Isomeric SMILES

CCN(CC)C(=O)CSC1=C(C(=O)C2=CC=CC=C2N1)C(=O)OC

InChI

InChI=1S/C17H20N2O4S/c1-4-19(5-2)13(20)10-24-16-14(17(22)23-3)15(21)11-8-6-7-9-12(11)18-16/h6-9H,4-5,10H2,1-3H3,(H,18,21)