2-[3-(4-methyl-2-pyridin-2-yl-1,3-thiazol-5-yl)-3-oxidanylidene-1-phenyl-propyl]propanedinitrile

Systemtic Name: 2-[3-(4-methyl-2-pyridin-2-yl-1,3-thiazol-5-yl)-3-oxidanylidene-1-phenyl-propyl]propanedinitrile Openeye Name: 2-[3-[4-methyl-2-(2-pyridyl)thiazol-5-yl]-3-oxo-1-phenyl-propyl]propanedinitrile CAS Name: 2-[3-[4-methyl-2-(2-pyridinyl)-5-thiazolyl]-3-oxo-1-phenylpropyl]propanedinitrile IUPAC Name: 2-[3-(4-methyl-2-pyridin-2-yl-1,3-thiazol-5-yl)-3-oxo-1-phenylpropyl]propanedinitrile Traditional Name: 2-[3-keto-3-[4-methyl-2-(2-pyridyl)thiazol-5-yl]-1-phenyl-propyl]malononitrile Formula: C21H16N4OS MolecularWeight: 372.44294

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)C2=CC=CC=N2)C(=O)CC(C3=CC=CC=C3)C(C#N)C#N

Isomeric SMILES

CC1=C(SC(=N1)C2=CC=CC=N2)C(=O)CC(C3=CC=CC=C3)C(C#N)C#N

InChI

InChI=1S/C21H16N4OS/c1-14-20(27-21(25-14)18-9-5-6-10-24-18)19(26)11-17(16(12-22)13-23)15-7-3-2-4-8-15/h2-10,16-17H,11H2,1H3