tert-butyl (2Z)-2-cyano-2-[3-(phenylmethyl)-1,3-thiazolidin-2-ylidene]ethanoate

Systemtic Name: tert-butyl (2Z)-2-cyano-2-[3-(phenylmethyl)-1,3-thiazolidin-2-ylidene]ethanoate Openeye Name: tert-butyl (2Z)-2-(3-benzylthiazolidin-2-ylidene)-2-cyano-acetate CAS Name: (2Z)-2-cyano-2-[3-(phenylmethyl)-2-thiazolidinylidene]acetic acid tert-butyl ester IUPAC Name: tert-butyl (2Z)-2-(3-benzyl-1,3-thiazolidin-2-ylidene)-2-cyanoacetate Traditional Name: (2Z)-2-(3-benzylthiazolidin-2-ylidene)-2-cyano-acetic acid tert-butyl ester Formula: C17H20N2O2S MolecularWeight: 316.4179

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C(=C1N(CCS1)CC2=CC=CC=C2)C#N

Isomeric SMILES

CC(C)(C)OC(=O)/C(=C\1/N(CCS1)CC2=CC=CC=C2)/C#N

InChI

InChI=1S/C17H20N2O2S/c1-17(2,3)21-16(20)14(11-18)15-19(9-10-22-15)12-13-7-5-4-6-8-13/h4-8H,9-10,12H2,1-3H3/b15-14-