(E)-2-cyano-N-(3-cyanothiophen-2-yl)-3-[3-phenyl-1-(phenylmethyl)pyrazol-4-yl]prop-2-enamide

Systemtic Name: (E)-2-cyano-N-(3-cyanothiophen-2-yl)-3-[3-phenyl-1-(phenylmethyl)pyrazol-4-yl]prop-2-enamide Openeye Name: (E)-3-(1-benzyl-3-phenyl-pyrazol-4-yl)-2-cyano-N-(3-cyano-2-thienyl)prop-2-enamide CAS Name: (E)-2-cyano-N-(3-cyano-2-thiophenyl)-3-[3-phenyl-1-(phenylmethyl)-4-pyrazolyl]-2-propenamide IUPAC Name: (E)-3-(1-benzyl-3-phenylpyrazol-4-yl)-2-cyano-N-(3-cyanothiophen-2-yl)prop-2-enamide Traditional Name: (E)-3-(1-benzyl-3-phenyl-pyrazol-4-yl)-2-cyano-N-(3-cyano-2-thienyl)acrylamide Formula: C25H17N5OS MolecularWeight: 435.50038

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C=C(C(=N2)C3=CC=CC=C3)C=C(C#N)C(=O)NC4=C(C=CS4)C#N

Isomeric SMILES

C1=CC=C(C=C1)CN2C=C(C(=N2)C3=CC=CC=C3)/C=C(\C#N)/C(=O)NC4=C(C=CS4)C#N

InChI

InChI=1S/C25H17N5OS/c26-14-20-11-12-32-25(20)28-24(31)21(15-27)13-22-17-30(16-18-7-3-1-4-8-18)29-23(22)19-9-5-2-6-10-19/h1-13,17H,16H2,(H,28,31)/b21-13+