ethyl 3-cyano-2-(1-ethoxy-1-oxidanylidene-propan-2-yl)sulfanyl-5,6,7,8-tetrahydroquinoline-4-carboxylate

Systemtic Name: ethyl 3-cyano-2-(1-ethoxy-1-oxidanylidene-propan-2-yl)sulfanyl-5,6,7,8-tetrahydroquinoline-4-carboxylate Openeye Name: ethyl 3-cyano-2-(2-ethoxy-1-methyl-2-oxo-ethyl)sulfanyl-5,6,7,8-tetrahydroquinoline-4-carboxylate CAS Name: 3-cyano-2-[(1-ethoxy-1-oxopropan-2-yl)thio]-5,6,7,8-tetrahydroquinoline-4-carboxylic acid ethyl ester IUPAC Name: ethyl 3-cyano-2-(1-ethoxy-1-oxopropan-2-yl)sulfanyl-5,6,7,8-tetrahydroquinoline-4-carboxylate Traditional Name: 3-cyano-2-[(2-ethoxy-2-keto-1-methyl-ethyl)thio]-5,6,7,8-tetrahydroquinoline-4-carboxylic acid ethyl ester Formula: C18H22N2O4S MolecularWeight: 362.44328

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=NC2=C1CCCC2)SC(C)C(=O)OCC)C#N

Isomeric SMILES

CCOC(=O)C1=C(C(=NC2=C1CCCC2)SC(C)C(=O)OCC)C#N

InChI

InChI=1S/C18H22N2O4S/c1-4-23-17(21)11(3)25-16-13(10-19)15(18(22)24-5-2)12-8-6-7-9-14(12)20-16/h11H,4-9H2,1-3H3