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

Systemtic Name: (E)-2-cyano-3-[3-(4-methylphenyl)-1-(phenylmethyl)pyrazol-4-yl]-N-prop-2-enyl-prop-2-enamide Openeye Name: (E)-N-allyl-3-[1-benzyl-3-(p-tolyl)pyrazol-4-yl]-2-cyano-prop-2-enamide CAS Name: (E)-2-cyano-3-[3-(4-methylphenyl)-1-(phenylmethyl)-4-pyrazolyl]-N-prop-2-enyl-2-propenamide IUPAC Name: (E)-3-[1-benzyl-3-(4-methylphenyl)pyrazol-4-yl]-2-cyano-N-prop-2-enylprop-2-enamide Traditional Name: (E)-N-allyl-3-[1-benzyl-3-(p-tolyl)pyrazol-4-yl]-2-cyano-acrylamide Formula: C24H22N4O MolecularWeight: 382.45768

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN(C=C2C=C(C#N)C(=O)NCC=C)CC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN(C=C2/C=C(\C#N)/C(=O)NCC=C)CC3=CC=CC=C3

InChI

InChI=1S/C24H22N4O/c1-3-13-26-24(29)21(15-25)14-22-17-28(16-19-7-5-4-6-8-19)27-23(22)20-11-9-18(2)10-12-20/h3-12,14,17H,1,13,16H2,2H3,(H,26,29)/b21-14+