(E)-N-(4-chloranyl-2-methoxy-5-methyl-phenyl)-2-cyano-3-(1-phenylpyrazol-4-yl)prop-2-enamide

Systemtic Name: (E)-N-(4-chloranyl-2-methoxy-5-methyl-phenyl)-2-cyano-3-(1-phenylpyrazol-4-yl)prop-2-enamide Openeye Name: (E)-N-(4-chloro-2-methoxy-5-methyl-phenyl)-2-cyano-3-(1-phenylpyrazol-4-yl)prop-2-enamide CAS Name: (E)-N-(4-chloro-2-methoxy-5-methylphenyl)-2-cyano-3-(1-phenyl-4-pyrazolyl)-2-propenamide IUPAC Name: (E)-N-(4-chloro-2-methoxy-5-methylphenyl)-2-cyano-3-(1-phenylpyrazol-4-yl)prop-2-enamide Traditional Name: (E)-N-(4-chloro-2-methoxy-5-methyl-phenyl)-2-cyano-3-(1-phenylpyrazol-4-yl)acrylamide Formula: C21H17ClN4O2 MolecularWeight: 392.83828

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1Cl)OC)NC(=O)C(=CC2=CN(N=C2)C3=CC=CC=C3)C#N

Isomeric SMILES

CC1=CC(=C(C=C1Cl)OC)NC(=O)/C(=C/C2=CN(N=C2)C3=CC=CC=C3)/C#N

InChI

InChI=1S/C21H17ClN4O2/c1-14-8-19(20(28-2)10-18(14)22)25-21(27)16(11-23)9-15-12-24-26(13-15)17-6-4-3-5-7-17/h3-10,12-13H,1-2H3,(H,25,27)/b16-9+