methyl 2-[(2S,3S)-2-cyano-2,3-dimethyl-5-sulfanylidene-pyrrolidin-3-yl]ethanoate

Systemtic Name: methyl 2-[(2S,3S)-2-cyano-2,3-dimethyl-5-sulfanylidene-pyrrolidin-3-yl]ethanoate Openeye Name: methyl 2-[(2S,3S)-2-cyano-2,3-dimethyl-5-thioxo-pyrrolidin-3-yl]acetate CAS Name: 2-[(2S,3S)-2-cyano-2,3-dimethyl-5-sulfanylidene-3-pyrrolidinyl]acetic acid methyl ester IUPAC Name: methyl 2-[(2S,3S)-2-cyano-2,3-dimethyl-5-sulfanylidenepyrrolidin-3-yl]acetate Traditional Name: 2-[(2S,3S)-2-cyano-2,3-dimethyl-5-thioxo-pyrrolidin-3-yl]acetic acid methyl ester Formula: C10H14N2O2S MolecularWeight: 226.29536

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C[C@@]1(CC(=S)N[C@]1(C)C#N)CC(=O)OC

InChI

InChI=1S/C10H14N2O2S/c1-9(5-8(13)14-3)4-7(15)12-10(9,2)6-11/h4-5H2,1-3H3,(H,12,15)/t9-,10-/m1/s1