tert-butyl (2Z)-2-[2-(4-chlorophenyl)-3,3-dicyano-prop-2-enylidene]-1,3-thiazolidine-3-carboxylate

Systemtic Name: tert-butyl (2Z)-2-[2-(4-chlorophenyl)-3,3-dicyano-prop-2-enylidene]-1,3-thiazolidine-3-carboxylate Openeye Name: tert-butyl (2Z)-2-[2-(4-chlorophenyl)-3,3-dicyano-prop-2-enylidene]thiazolidine-3-carboxylate CAS Name: (2Z)-2-[2-(4-chlorophenyl)-3,3-dicyanoprop-2-enylidene]-3-thiazolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (2Z)-2-[2-(4-chlorophenyl)-3,3-dicyanoprop-2-enylidene]-1,3-thiazolidine-3-carboxylate Traditional Name: (2Z)-2-[2-(4-chlorophenyl)-3,3-dicyano-prop-2-enylidene]thiazolidine-3-carboxylic acid tert-butyl ester Formula: C19H18ClN3O2S MolecularWeight: 387.88312

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCSC1=CC(=C(C#N)C#N)C2=CC=C(C=C2)Cl

Isomeric SMILES

CC(C)(C)OC(=O)N\1CCS/C1=C\C(=C(C#N)C#N)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C19H18ClN3O2S/c1-19(2,3)25-18(24)23-8-9-26-17(23)10-16(14(11-21)12-22)13-4-6-15(20)7-5-13/h4-7,10H,8-9H2,1-3H3/b17-10-