(E)-3-(5-bromanyl-2-methoxy-phenyl)-N-methyl-N-[[1-(phenylmethyl)pyrazol-4-yl]methyl]prop-2-enamide

Systemtic Name: (E)-3-(5-bromanyl-2-methoxy-phenyl)-N-methyl-N-[[1-(phenylmethyl)pyrazol-4-yl]methyl]prop-2-enamide Openeye Name: (E)-N-[(1-benzylpyrazol-4-yl)methyl]-3-(5-bromo-2-methoxy-phenyl)-N-methyl-prop-2-enamide CAS Name: (E)-3-(5-bromo-2-methoxyphenyl)-N-methyl-N-[[1-(phenylmethyl)-4-pyrazolyl]methyl]-2-propenamide IUPAC Name: (E)-N-[(1-benzylpyrazol-4-yl)methyl]-3-(5-bromo-2-methoxyphenyl)-N-methylprop-2-enamide Traditional Name: (E)-N-[(1-benzylpyrazol-4-yl)methyl]-3-(5-bromo-2-methoxy-phenyl)-N-methyl-acrylamide Formula: C22H22BrN3O2 MolecularWeight: 440.33298

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H22BrN3O2/c1-25(22(27)11-8-19-12-20(23)9-10-21(19)28-2)14-18-13-24-26(16-18)15-17-6-4-3-5-7-17/h3-13,16H,14-15H2,1-2H3/b11-8+