(E)-2-cyano-3-[1-(2-methylphenyl)-3-phenyl-pyrazol-4-yl]-N-(1,3-thiazol-2-yl)prop-2-enamide

Systemtic Name: (E)-2-cyano-3-[1-(2-methylphenyl)-3-phenyl-pyrazol-4-yl]-N-(1,3-thiazol-2-yl)prop-2-enamide Openeye Name: (E)-2-cyano-3-[1-(o-tolyl)-3-phenyl-pyrazol-4-yl]-N-thiazol-2-yl-prop-2-enamide CAS Name: (E)-2-cyano-3-[1-(2-methylphenyl)-3-phenyl-4-pyrazolyl]-N-(2-thiazolyl)-2-propenamide IUPAC Name: (E)-2-cyano-3-[1-(2-methylphenyl)-3-phenylpyrazol-4-yl]-N-(1,3-thiazol-2-yl)prop-2-enamide Traditional Name: (E)-2-cyano-3-[1-(o-tolyl)-3-phenyl-pyrazol-4-yl]-N-thiazol-2-yl-acrylamide Formula: C23H17N5OS MolecularWeight: 411.47898

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C=C(C(=N2)C3=CC=CC=C3)C=C(C#N)C(=O)NC4=NC=CS4

Isomeric SMILES

CC1=CC=CC=C1N2C=C(C(=N2)C3=CC=CC=C3)/C=C(\C#N)/C(=O)NC4=NC=CS4

InChI

InChI=1S/C23H17N5OS/c1-16-7-5-6-10-20(16)28-15-19(21(27-28)17-8-3-2-4-9-17)13-18(14-24)22(29)26-23-25-11-12-30-23/h2-13,15H,1H3,(H,25,26,29)/b18-13+