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

Systemtic Name: 2-[[3-methyl-5-oxidanylidene-1-(4-phenyl-1,3-thiazol-2-yl)-4H-pyrazol-4-yl]-phenyl-methyl]propanedinitrile Openeye Name: 2-[[3-methyl-5-oxo-1-(4-phenylthiazol-2-yl)-4H-pyrazol-4-yl]-phenyl-methyl]propanedinitrile CAS Name: 2-[[3-methyl-5-oxo-1-(4-phenyl-2-thiazolyl)-4H-pyrazol-4-yl]-phenylmethyl]propanedinitrile IUPAC Name: 2-[[3-methyl-5-oxo-1-(4-phenyl-1,3-thiazol-2-yl)-4H-pyrazol-4-yl]-phenylmethyl]propanedinitrile Traditional Name: 2-[[5-keto-3-methyl-1-(4-phenylthiazol-2-yl)-2-pyrazolin-4-yl]-phenyl-methyl]malononitrile Formula: C23H17N5OS MolecularWeight: 411.47898

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1C(C2=CC=CC=C2)C(C#N)C#N)C3=NC(=CS3)C4=CC=CC=C4

Isomeric SMILES

CC1=NN(C(=O)C1C(C2=CC=CC=C2)C(C#N)C#N)C3=NC(=CS3)C4=CC=CC=C4

InChI

InChI=1S/C23H17N5OS/c1-15-20(21(18(12-24)13-25)17-10-6-3-7-11-17)22(29)28(27-15)23-26-19(14-30-23)16-8-4-2-5-9-16/h2-11,14,18,20-21H,1H3