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

Systemtic Name: (E)-3-(4-bromophenyl)-N-methyl-N-[[1-(phenylmethyl)pyrazol-4-yl]methyl]prop-2-enamide Openeye Name: (E)-N-[(1-benzylpyrazol-4-yl)methyl]-3-(4-bromophenyl)-N-methyl-prop-2-enamide CAS Name: (E)-3-(4-bromophenyl)-N-methyl-N-[[1-(phenylmethyl)-4-pyrazolyl]methyl]-2-propenamide IUPAC Name: (E)-N-[(1-benzylpyrazol-4-yl)methyl]-3-(4-bromophenyl)-N-methylprop-2-enamide Traditional Name: (E)-N-[(1-benzylpyrazol-4-yl)methyl]-3-(4-bromophenyl)-N-methyl-acrylamide Formula: C21H20BrN3O MolecularWeight: 410.307

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CN(N=C1)CC2=CC=CC=C2)C(=O)C=CC3=CC=C(C=C3)Br

Isomeric SMILES

CN(CC1=CN(N=C1)CC2=CC=CC=C2)C(=O)/C=C/C3=CC=C(C=C3)Br

InChI

InChI=1S/C21H20BrN3O/c1-24(21(26)12-9-17-7-10-20(22)11-8-17)14-19-13-23-25(16-19)15-18-5-3-2-4-6-18/h2-13,16H,14-15H2,1H3/b12-9+