2-cyano-N-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-3-(3-phenoxyphenyl)prop-2-enamide

Systemtic Name: 2-cyano-N-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-3-(3-phenoxyphenyl)prop-2-enamide Openeye Name: 2-cyano-N-(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)-3-(3-phenoxyphenyl)prop-2-enamide CAS Name: 2-cyano-N-(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)-3-(3-phenoxyphenyl)-2-propenamide IUPAC Name: 2-cyano-N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-3-(3-phenoxyphenyl)prop-2-enamide Traditional Name: 2-cyano-N-(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)-3-(3-phenoxyphenyl)acrylamide Formula: C27H22N4O3 MolecularWeight: 450.48858

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=O)C(=CC3=CC(=CC=C3)OC4=CC=CC=C4)C#N

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=O)C(=CC3=CC(=CC=C3)OC4=CC=CC=C4)C#N

InChI

InChI=1S/C27H22N4O3/c1-19-25(27(33)31(30(19)2)22-11-5-3-6-12-22)29-26(32)21(18-28)16-20-10-9-15-24(17-20)34-23-13-7-4-8-14-23/h3-17H,1-2H3,(H,29,32)