S-tert-butyl (2Z)-2-(5-cyano-4,4,5-trimethyl-pyrrolidin-3-ylidene)ethanethioate

Systemtic Name: S-tert-butyl (2Z)-2-(5-cyano-4,4,5-trimethyl-pyrrolidin-3-ylidene)ethanethioate Openeye Name: S-tert-butyl (2Z)-2-(5-cyano-4,4,5-trimethyl-pyrrolidin-3-ylidene)ethanethioate CAS Name: (2Z)-2-(5-cyano-4,4,5-trimethyl-3-pyrrolidinylidene)ethanethioic acid S-tert-butyl ester IUPAC Name: S-tert-butyl (2Z)-2-(5-cyano-4,4,5-trimethylpyrrolidin-3-ylidene)ethanethioate Traditional Name: (2Z)-2-(5-cyano-4,4,5-trimethyl-pyrrolidin-3-ylidene)ethanethioic acid S-tert-butyl ester Formula: C14H22N2OS MolecularWeight: 266.40228

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=CC(=O)SC(C)(C)C)CNC1(C)C#N)C

Isomeric SMILES

CC1(/C(=C/C(=O)SC(C)(C)C)/CNC1(C)C#N)C

InChI

InChI=1S/C14H22N2OS/c1-12(2,3)18-11(17)7-10-8-16-14(6,9-15)13(10,4)5/h7,16H,8H2,1-6H3/b10-7+