methyl 3-[5-cyano-4-(2-methoxy-2-oxidanylidene-ethyl)-4,5-dimethyl-2-sulfanylidene-pyrrolidin-3-yl]propanoate

Systemtic Name: methyl 3-[5-cyano-4-(2-methoxy-2-oxidanylidene-ethyl)-4,5-dimethyl-2-sulfanylidene-pyrrolidin-3-yl]propanoate Openeye Name: methyl 3-[5-cyano-4-(2-methoxy-2-oxo-ethyl)-4,5-dimethyl-2-thioxo-pyrrolidin-3-yl]propanoate CAS Name: 3-[5-cyano-4-(2-methoxy-2-oxoethyl)-4,5-dimethyl-2-sulfanylidene-3-pyrrolidinyl]propanoic acid methyl ester IUPAC Name: methyl 3-[5-cyano-4-(2-methoxy-2-oxoethyl)-4,5-dimethyl-2-sulfanylidenepyrrolidin-3-yl]propanoate Traditional Name: 3-[5-cyano-4-(2-keto-2-methoxy-ethyl)-4,5-dimethyl-2-thioxo-pyrrolidin-3-yl]propionic acid methyl ester Formula: C14H20N2O4S MolecularWeight: 312.3846

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C(=S)NC1(C)C#N)CCC(=O)OC)CC(=O)OC

Isomeric SMILES

CC1(C(C(=S)NC1(C)C#N)CCC(=O)OC)CC(=O)OC

InChI

InChI=1S/C14H20N2O4S/c1-13(7-11(18)20-4)9(5-6-10(17)19-3)12(21)16-14(13,2)8-15/h9H,5-7H2,1-4H3,(H,16,21)