N-[(E)-1-cyano-1-(3,5-dimethylphenyl)-3,3-dimethyl-but-1-en-2-yl]-2,4-dimethyl-1,3-thiazole-5-carboxamide

Systemtic Name: N-[(E)-1-cyano-1-(3,5-dimethylphenyl)-3,3-dimethyl-but-1-en-2-yl]-2,4-dimethyl-1,3-thiazole-5-carboxamide Openeye Name: N-[(1E)-1-[cyano-(3,5-dimethylphenyl)methylene]-2,2-dimethyl-propyl]-2,4-dimethyl-thiazole-5-carboxamide CAS Name: N-[(E)-1-cyano-1-(3,5-dimethylphenyl)-3,3-dimethylbut-1-en-2-yl]-2,4-dimethyl-5-thiazolecarboxamide IUPAC Name: N-[(E)-1-cyano-1-(3,5-dimethylphenyl)-3,3-dimethylbut-1-en-2-yl]-2,4-dimethyl-1,3-thiazole-5-carboxamide Traditional Name: N-[(E)-1-tert-butyl-2-cyano-2-(3,5-dimethylphenyl)vinyl]-2,4-dimethyl-thiazole-5-carboxamide Formula: C21H25N3OS MolecularWeight: 367.5077

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)C(=C(C(C)(C)C)NC(=O)C2=C(N=C(S2)C)C)C#N)C

Isomeric SMILES

CC1=CC(=CC(=C1)/C(=C(/C(C)(C)C)\NC(=O)C2=C(N=C(S2)C)C)/C#N)C

InChI

InChI=1S/C21H25N3OS/c1-12-8-13(2)10-16(9-12)17(11-22)19(21(5,6)7)24-20(25)18-14(3)23-15(4)26-18/h8-10H,1-7H3,(H,24,25)/b19-17-