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

Systemtic Name: (E)-N-(3-acetamidophenyl)-3-[5-chloranyl-3-methyl-1-(phenylmethyl)pyrazol-4-yl]prop-2-enamide Openeye Name: (E)-N-(3-acetamidophenyl)-3-(1-benzyl-5-chloro-3-methyl-pyrazol-4-yl)prop-2-enamide CAS Name: (E)-N-(3-acetamidophenyl)-3-[5-chloro-3-methyl-1-(phenylmethyl)-4-pyrazolyl]-2-propenamide IUPAC Name: (E)-N-(3-acetamidophenyl)-3-(1-benzyl-5-chloro-3-methylpyrazol-4-yl)prop-2-enamide Traditional Name: (E)-N-(3-acetamidophenyl)-3-(1-benzyl-5-chloro-3-methyl-pyrazol-4-yl)acrylamide Formula: C22H21ClN4O2 MolecularWeight: 408.88074

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C=CC(=O)NC2=CC(=CC=C2)NC(=O)C)Cl)CC3=CC=CC=C3

Isomeric SMILES

CC1=NN(C(=C1/C=C/C(=O)NC2=CC(=CC=C2)NC(=O)C)Cl)CC3=CC=CC=C3

InChI

InChI=1S/C22H21ClN4O2/c1-15-20(22(23)27(26-15)14-17-7-4-3-5-8-17)11-12-21(29)25-19-10-6-9-18(13-19)24-16(2)28/h3-13H,14H2,1-2H3,(H,24,28)(H,25,29)/b12-11+