diethyl 5-cyano-6-pyrrolidin-1-yl-3,4-dihydrothiopyran-2,2-dicarboxylate

Systemtic Name: diethyl 5-cyano-6-pyrrolidin-1-yl-3,4-dihydrothiopyran-2,2-dicarboxylate Openeye Name: diethyl 5-cyano-6-pyrrolidin-1-yl-3,4-dihydrothiopyran-2,2-dicarboxylate CAS Name: 5-cyano-6-(1-pyrrolidinyl)-3,4-dihydrothiopyran-2,2-dicarboxylic acid diethyl ester IUPAC Name: diethyl 5-cyano-6-pyrrolidin-1-yl-3,4-dihydrothiopyran-2,2-dicarboxylate Traditional Name: 5-cyano-6-pyrrolidino-3,4-dihydrothiopyran-2,2-dicarboxylic acid diethyl ester Formula: C16H22N2O4S MolecularWeight: 338.42188

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCC(=C(S1)N2CCCC2)C#N)C(=O)OCC

Isomeric SMILES

CCOC(=O)C1(CCC(=C(S1)N2CCCC2)C#N)C(=O)OCC

InChI

InChI=1S/C16H22N2O4S/c1-3-21-14(19)16(15(20)22-4-2)8-7-12(11-17)13(23-16)18-9-5-6-10-18/h3-10H2,1-2H3