(Z)-2-cyano-3-[3-(3-methyl-4-prop-2-enoxy-phenyl)-1-phenyl-pyrazol-4-yl]-N-(1-phenylethyl)prop-2-enamide

Systemtic Name: (Z)-2-cyano-3-[3-(3-methyl-4-prop-2-enoxy-phenyl)-1-phenyl-pyrazol-4-yl]-N-(1-phenylethyl)prop-2-enamide Openeye Name: (Z)-3-[3-(4-allyloxy-3-methyl-phenyl)-1-phenyl-pyrazol-4-yl]-2-cyano-N-(1-phenylethyl)prop-2-enamide CAS Name: (Z)-2-cyano-3-[3-(3-methyl-4-prop-2-enoxyphenyl)-1-phenyl-4-pyrazolyl]-N-(1-phenylethyl)-2-propenamide IUPAC Name: (Z)-2-cyano-3-[3-(3-methyl-4-prop-2-enoxyphenyl)-1-phenylpyrazol-4-yl]-N-(1-phenylethyl)prop-2-enamide Traditional Name: (Z)-3-[3-(4-allyloxy-3-methyl-phenyl)-1-phenyl-pyrazol-4-yl]-2-cyano-N-(1-phenylethyl)acrylamide Formula: C31H28N4O2 MolecularWeight: 488.57962

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C2=NN(C=C2C=C(C#N)C(=O)NC(C)C3=CC=CC=C3)C4=CC=CC=C4)OCC=C

Isomeric SMILES

CC1=C(C=CC(=C1)C2=NN(C=C2/C=C(/C#N)\C(=O)NC(C)C3=CC=CC=C3)C4=CC=CC=C4)OCC=C

InChI

InChI=1S/C31H28N4O2/c1-4-17-37-29-16-15-25(18-22(29)2)30-27(21-35(34-30)28-13-9-6-10-14-28)19-26(20-32)31(36)33-23(3)24-11-7-5-8-12-24/h4-16,18-19,21,23H,1,17H2,2-3H3,(H,33,36)/b26-19-