tert-butyl (2E)-2-(3,3-dicyano-2-phenyl-prop-2-enylidene)-5-methyl-1,3-thiazole-3-carboxylate

Systemtic Name: tert-butyl (2E)-2-(3,3-dicyano-2-phenyl-prop-2-enylidene)-5-methyl-1,3-thiazole-3-carboxylate Openeye Name: tert-butyl (2E)-2-(3,3-dicyano-2-phenyl-prop-2-enylidene)-5-methyl-thiazole-3-carboxylate CAS Name: (2E)-2-(3,3-dicyano-2-phenylprop-2-enylidene)-5-methyl-3-thiazolecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (2E)-2-(3,3-dicyano-2-phenylprop-2-enylidene)-5-methyl-1,3-thiazole-3-carboxylate Traditional Name: (2E)-2-(3,3-dicyano-2-phenyl-prop-2-enylidene)-5-methyl-4-thiazoline-3-carboxylic acid tert-butyl ester Formula: C20H19N3O2S MolecularWeight: 365.44876

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN(C(=CC(=C(C#N)C#N)C2=CC=CC=C2)S1)C(=O)OC(C)(C)C

Isomeric SMILES

CC1=CN(/C(=C\C(=C(C#N)C#N)C2=CC=CC=C2)/S1)C(=O)OC(C)(C)C

InChI

InChI=1S/C20H19N3O2S/c1-14-13-23(19(24)25-20(2,3)4)18(26-14)10-17(16(11-21)12-22)15-8-6-5-7-9-15/h5-10,13H,1-4H3/b18-10+