(E)-N-(4,5-dimethoxy-2-methyl-phenyl)-3-[1-(phenylmethyl)-3-pyridin-3-yl-pyrazol-4-yl]prop-2-enamide

Systemtic Name: (E)-N-(4,5-dimethoxy-2-methyl-phenyl)-3-[1-(phenylmethyl)-3-pyridin-3-yl-pyrazol-4-yl]prop-2-enamide Openeye Name: (E)-3-[1-benzyl-3-(3-pyridyl)pyrazol-4-yl]-N-(4,5-dimethoxy-2-methyl-phenyl)prop-2-enamide CAS Name: (E)-N-(4,5-dimethoxy-2-methylphenyl)-3-[1-(phenylmethyl)-3-(3-pyridinyl)-4-pyrazolyl]-2-propenamide IUPAC Name: (E)-3-(1-benzyl-3-pyridin-3-ylpyrazol-4-yl)-N-(4,5-dimethoxy-2-methylphenyl)prop-2-enamide Traditional Name: (E)-3-[1-benzyl-3-(3-pyridyl)pyrazol-4-yl]-N-(4,5-dimethoxy-2-methyl-phenyl)acrylamide Formula: C27H26N4O3 MolecularWeight: 454.52034

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1NC(=O)C=CC2=CN(N=C2C3=CN=CC=C3)CC4=CC=CC=C4)OC)OC

Isomeric SMILES

CC1=CC(=C(C=C1NC(=O)/C=C/C2=CN(N=C2C3=CN=CC=C3)CC4=CC=CC=C4)OC)OC

InChI

InChI=1S/C27H26N4O3/c1-19-14-24(33-2)25(34-3)15-23(19)29-26(32)12-11-22-18-31(17-20-8-5-4-6-9-20)30-27(22)21-10-7-13-28-16-21/h4-16,18H,17H2,1-3H3,(H,29,32)/b12-11+