(E)-2-[4-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-1,3-thiazol-2-yl]-3-methylsulfanyl-3-phenylazanyl-prop-2-enenitrile

Systemtic Name: (E)-2-[4-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-1,3-thiazol-2-yl]-3-methylsulfanyl-3-phenylazanyl-prop-2-enenitrile Openeye Name: (E)-3-anilino-2-[4-(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)thiazol-2-yl]-3-methylsulfanyl-prop-2-enenitrile CAS Name: (E)-3-anilino-2-[4-(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)-2-thiazolyl]-3-(methylthio)-2-propenenitrile IUPAC Name: (E)-3-anilino-2-[4-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-1,3-thiazol-2-yl]-3-methylsulfanylprop-2-enenitrile Traditional Name: (E)-3-anilino-2-[4-(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)thiazol-2-yl]-3-(methylthio)acrylonitrile Formula: C24H21N5OS2 MolecularWeight: 459.58644

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)C3=CSC(=N3)C(=C(NC4=CC=CC=C4)SC)C#N

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)C3=CSC(=N3)/C(=C(\NC4=CC=CC=C4)/SC)/C#N

InChI

InChI=1S/C24H21N5OS2/c1-16-21(24(30)29(28(16)2)18-12-8-5-9-13-18)20-15-32-23(27-20)19(14-25)22(31-3)26-17-10-6-4-7-11-17/h4-13,15,26H,1-3H3/b22-19+