methyl (2R,3R)-4-cyano-3-methyl-5-pyrrolidin-1-yl-3,6-dihydro-2H-thiopyran-2-carboxylate

Systemtic Name: methyl (2R,3R)-4-cyano-3-methyl-5-pyrrolidin-1-yl-3,6-dihydro-2H-thiopyran-2-carboxylate Openeye Name: methyl (2R,3R)-4-cyano-3-methyl-5-pyrrolidin-1-yl-3,6-dihydro-2H-thiopyran-2-carboxylate CAS Name: (2R,3R)-4-cyano-3-methyl-5-(1-pyrrolidinyl)-3,6-dihydro-2H-thiopyran-2-carboxylic acid methyl ester IUPAC Name: methyl (2R,3R)-4-cyano-3-methyl-5-pyrrolidin-1-yl-3,6-dihydro-2H-thiopyran-2-carboxylate Traditional Name: (2R,3R)-4-cyano-3-methyl-5-pyrrolidino-3,6-dihydro-2H-thiopyran-2-carboxylic acid methyl ester Formula: C13H18N2O2S MolecularWeight: 266.35922

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(SCC(=C1C#N)N2CCCC2)C(=O)OC

Isomeric SMILES

C[C@H]1[C@@H](SCC(=C1C#N)N2CCCC2)C(=O)OC

InChI

InChI=1S/C13H18N2O2S/c1-9-10(7-14)11(15-5-3-4-6-15)8-18-12(9)13(16)17-2/h9,12H,3-6,8H2,1-2H3/t9-,12-/m1/s1