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

Systemtic Name: (E)-N-(4-acetamido-3-methyl-phenyl)-3-[5-chloranyl-3-methyl-1-(2-methylpropyl)pyrazol-4-yl]prop-2-enamide Openeye Name: (E)-N-(4-acetamido-3-methyl-phenyl)-3-(5-chloro-1-isobutyl-3-methyl-pyrazol-4-yl)prop-2-enamide CAS Name: (E)-N-(4-acetamido-3-methylphenyl)-3-[5-chloro-3-methyl-1-(2-methylpropyl)-4-pyrazolyl]-2-propenamide IUPAC Name: (E)-N-(4-acetamido-3-methylphenyl)-3-[5-chloro-3-methyl-1-(2-methylpropyl)pyrazol-4-yl]prop-2-enamide Traditional Name: (E)-N-(4-acetamido-3-methyl-phenyl)-3-(5-chloro-1-isobutyl-3-methyl-pyrazol-4-yl)acrylamide Formula: C20H25ClN4O2 MolecularWeight: 388.8911

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=O)C=CC2=C(N(N=C2C)CC(C)C)Cl)NC(=O)C

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=O)/C=C/C2=C(N(N=C2C)CC(C)C)Cl)NC(=O)C

InChI

InChI=1S/C20H25ClN4O2/c1-12(2)11-25-20(21)17(14(4)24-25)7-9-19(27)23-16-6-8-18(13(3)10-16)22-15(5)26/h6-10,12H,11H2,1-5H3,(H,22,26)(H,23,27)/b9-7+