(E)-3-[5-chloranyl-3-methyl-1-(2-methylpropyl)pyrazol-4-yl]-N-(2-phenoxyphenyl)prop-2-enamide

Systemtic Name: (E)-3-[5-chloranyl-3-methyl-1-(2-methylpropyl)pyrazol-4-yl]-N-(2-phenoxyphenyl)prop-2-enamide Openeye Name: (E)-3-(5-chloro-1-isobutyl-3-methyl-pyrazol-4-yl)-N-(2-phenoxyphenyl)prop-2-enamide CAS Name: (E)-3-[5-chloro-3-methyl-1-(2-methylpropyl)-4-pyrazolyl]-N-(2-phenoxyphenyl)-2-propenamide IUPAC Name: (E)-3-[5-chloro-3-methyl-1-(2-methylpropyl)pyrazol-4-yl]-N-(2-phenoxyphenyl)prop-2-enamide Traditional Name: (E)-3-(5-chloro-1-isobutyl-3-methyl-pyrazol-4-yl)-N-(2-phenoxyphenyl)acrylamide Formula: C23H24ClN3O2 MolecularWeight: 409.90856

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C=CC(=O)NC2=CC=CC=C2OC3=CC=CC=C3)Cl)CC(C)C

Isomeric SMILES

CC1=NN(C(=C1/C=C/C(=O)NC2=CC=CC=C2OC3=CC=CC=C3)Cl)CC(C)C

InChI

InChI=1S/C23H24ClN3O2/c1-16(2)15-27-23(24)19(17(3)26-27)13-14-22(28)25-20-11-7-8-12-21(20)29-18-9-5-4-6-10-18/h4-14,16H,15H2,1-3H3,(H,25,28)/b14-13+