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

Systemtic Name: (E)-3-(5-chloranyl-3-methyl-1-phenyl-pyrazol-4-yl)-N-[(4-dimethylaminophenyl)methyl]prop-2-enamide Openeye Name: (E)-3-(5-chloro-3-methyl-1-phenyl-pyrazol-4-yl)-N-[(4-dimethylaminophenyl)methyl]prop-2-enamide CAS Name: (E)-3-(5-chloro-3-methyl-1-phenyl-4-pyrazolyl)-N-[(4-dimethylaminophenyl)methyl]-2-propenamide IUPAC Name: (E)-3-(5-chloro-3-methyl-1-phenylpyrazol-4-yl)-N-[(4-dimethylaminophenyl)methyl]prop-2-enamide Traditional Name: (E)-3-(5-chloro-3-methyl-1-phenyl-pyrazol-4-yl)-N-[4-(dimethylamino)benzyl]acrylamide Formula: C22H23ClN4O MolecularWeight: 394.89722

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C=CC(=O)NCC2=CC=C(C=C2)N(C)C)Cl)C3=CC=CC=C3

Isomeric SMILES

CC1=NN(C(=C1/C=C/C(=O)NCC2=CC=C(C=C2)N(C)C)Cl)C3=CC=CC=C3

InChI

InChI=1S/C22H23ClN4O/c1-16-20(22(23)27(25-16)19-7-5-4-6-8-19)13-14-21(28)24-15-17-9-11-18(12-10-17)26(2)3/h4-14H,15H2,1-3H3,(H,24,28)/b14-13+