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

Systemtic Name: 2-[[3-oxidanylidene-5-phenyl-2-(4-phenyl-1,3-thiazol-2-yl)-1H-pyrazol-4-yl]-phenyl-methyl]propanedinitrile Openeye Name: 2-[[3-oxo-5-phenyl-2-(4-phenylthiazol-2-yl)-1H-pyrazol-4-yl]-phenyl-methyl]propanedinitrile CAS Name: 2-[[3-oxo-5-phenyl-2-(4-phenyl-2-thiazolyl)-1H-pyrazol-4-yl]-phenylmethyl]propanedinitrile IUPAC Name: 2-[[3-oxo-5-phenyl-2-(4-phenyl-1,3-thiazol-2-yl)-1H-pyrazol-4-yl]-phenylmethyl]propanedinitrile Traditional Name: 2-[[5-keto-3-phenyl-1-(4-phenylthiazol-2-yl)-3-pyrazolin-4-yl]-phenyl-methyl]malononitrile Formula: C28H19N5OS MolecularWeight: 473.54836

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CSC(=N2)N3C(=O)C(=C(N3)C4=CC=CC=C4)C(C5=CC=CC=C5)C(C#N)C#N

Isomeric SMILES

C1=CC=C(C=C1)C2=CSC(=N2)N3C(=O)C(=C(N3)C4=CC=CC=C4)C(C5=CC=CC=C5)C(C#N)C#N

InChI

InChI=1S/C28H19N5OS/c29-16-22(17-30)24(20-12-6-2-7-13-20)25-26(21-14-8-3-9-15-21)32-33(27(25)34)28-31-23(18-35-28)19-10-4-1-5-11-19/h1-15,18,22,24,32H