(E)-3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-N-(2-methyl-5-methylsulfonyl-phenyl)prop-2-enamide

Systemtic Name: (E)-3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-N-(2-methyl-5-methylsulfonyl-phenyl)prop-2-enamide Openeye Name: (E)-3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-N-(2-methyl-5-methylsulfonyl-phenyl)prop-2-enamide CAS Name: (E)-3-(3,5-dimethyl-1-phenyl-4-pyrazolyl)-N-(2-methyl-5-methylsulfonylphenyl)-2-propenamide IUPAC Name: (E)-3-(3,5-dimethyl-1-phenylpyrazol-4-yl)-N-(2-methyl-5-methylsulfonylphenyl)prop-2-enamide Traditional Name: (E)-3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-N-(5-mesyl-2-methyl-phenyl)acrylamide Formula: C22H23N3O3S MolecularWeight: 409.50132

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)C)NC(=O)C=CC2=C(N(N=C2C)C3=CC=CC=C3)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)C)NC(=O)/C=C/C2=C(N(N=C2C)C3=CC=CC=C3)C

InChI

InChI=1S/C22H23N3O3S/c1-15-10-11-19(29(4,27)28)14-21(15)23-22(26)13-12-20-16(2)24-25(17(20)3)18-8-6-5-7-9-18/h5-14H,1-4H3,(H,23,26)/b13-12+