methyl 2-(2-ethoxy-2-oxidanylidene-ethyl)sulfanyl-6-piperidin-1-yl-pyrimidine-4-carboxylate

Systemtic Name: methyl 2-(2-ethoxy-2-oxidanylidene-ethyl)sulfanyl-6-piperidin-1-yl-pyrimidine-4-carboxylate Openeye Name: methyl 2-(2-ethoxy-2-oxo-ethyl)sulfanyl-6-(1-piperidyl)pyrimidine-4-carboxylate CAS Name: 2-[(2-ethoxy-2-oxoethyl)thio]-6-(1-piperidinyl)-4-pyrimidinecarboxylic acid methyl ester IUPAC Name: methyl 2-(2-ethoxy-2-oxoethyl)sulfanyl-6-piperidin-1-ylpyrimidine-4-carboxylate Traditional Name: 2-[(2-ethoxy-2-keto-ethyl)thio]-6-piperidino-pyrimidine-4-carboxylic acid methyl ester Formula: C15H21N3O4S MolecularWeight: 339.40994

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSC1=NC(=CC(=N1)N2CCCCC2)C(=O)OC

Isomeric SMILES

CCOC(=O)CSC1=NC(=CC(=N1)N2CCCCC2)C(=O)OC

InChI

InChI=1S/C15H21N3O4S/c1-3-22-13(19)10-23-15-16-11(14(20)21-2)9-12(17-15)18-7-5-4-6-8-18/h9H,3-8,10H2,1-2H3