(E)-3-[3-phenyl-1-(phenylmethyl)pyrazol-4-yl]-N-(pyridin-4-ylmethyl)prop-2-enamide

Systemtic Name: (E)-3-[3-phenyl-1-(phenylmethyl)pyrazol-4-yl]-N-(pyridin-4-ylmethyl)prop-2-enamide Openeye Name: (E)-3-(1-benzyl-3-phenyl-pyrazol-4-yl)-N-(4-pyridylmethyl)prop-2-enamide CAS Name: (E)-3-[3-phenyl-1-(phenylmethyl)-4-pyrazolyl]-N-(pyridin-4-ylmethyl)-2-propenamide IUPAC Name: (E)-3-(1-benzyl-3-phenylpyrazol-4-yl)-N-(pyridin-4-ylmethyl)prop-2-enamide Traditional Name: (E)-3-(1-benzyl-3-phenyl-pyrazol-4-yl)-N-(4-pyridylmethyl)acrylamide Formula: C25H22N4O MolecularWeight: 394.46838

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C=C(C(=N2)C3=CC=CC=C3)C=CC(=O)NCC4=CC=NC=C4

Isomeric SMILES

C1=CC=C(C=C1)CN2C=C(C(=N2)C3=CC=CC=C3)/C=C/C(=O)NCC4=CC=NC=C4

InChI

InChI=1S/C25H22N4O/c30-24(27-17-20-13-15-26-16-14-20)12-11-23-19-29(18-21-7-3-1-4-8-21)28-25(23)22-9-5-2-6-10-22/h1-16,19H,17-18H2,(H,27,30)/b12-11+