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

Systemtic Name: (E)-3-(3-chloranyl-4-methyl-phenyl)-N-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)prop-2-enamide Openeye Name: (E)-3-(3-chloro-4-methyl-phenyl)-N-(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)prop-2-enamide CAS Name: (E)-3-(3-chloro-4-methylphenyl)-N-(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)-2-propenamide IUPAC Name: (E)-3-(3-chloro-4-methylphenyl)-N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)prop-2-enamide Traditional Name: (E)-3-(3-chloro-4-methyl-phenyl)-N-(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)acrylamide Formula: C21H20ClN3O2 MolecularWeight: 381.8554

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C=CC(=O)NC2=C(N(N(C2=O)C3=CC=CC=C3)C)C)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)/C=C/C(=O)NC2=C(N(N(C2=O)C3=CC=CC=C3)C)C)Cl

InChI

InChI=1S/C21H20ClN3O2/c1-14-9-10-16(13-18(14)22)11-12-19(26)23-20-15(2)24(3)25(21(20)27)17-7-5-4-6-8-17/h4-13H,1-3H3,(H,23,26)/b12-11+