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

Systemtic Name: (E)-2-cyano-3-(1-phenyl-3-pyridin-4-yl-pyrazol-4-yl)-N-(pyridin-3-ylmethyl)prop-2-enamide Openeye Name: (E)-2-cyano-3-[1-phenyl-3-(4-pyridyl)pyrazol-4-yl]-N-(3-pyridylmethyl)prop-2-enamide CAS Name: (E)-2-cyano-3-(1-phenyl-3-pyridin-4-yl-4-pyrazolyl)-N-(3-pyridinylmethyl)-2-propenamide IUPAC Name: (E)-2-cyano-3-(1-phenyl-3-pyridin-4-ylpyrazol-4-yl)-N-(pyridin-3-ylmethyl)prop-2-enamide Traditional Name: (E)-2-cyano-3-[1-phenyl-3-(4-pyridyl)pyrazol-4-yl]-N-(3-pyridylmethyl)acrylamide Formula: C24H18N6O MolecularWeight: 406.43932

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=C(C(=N2)C3=CC=NC=C3)C=C(C#N)C(=O)NCC4=CN=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)N2C=C(C(=N2)C3=CC=NC=C3)/C=C(\C#N)/C(=O)NCC4=CN=CC=C4

InChI

InChI=1S/C24H18N6O/c25-14-20(24(31)28-16-18-5-4-10-27-15-18)13-21-17-30(22-6-2-1-3-7-22)29-23(21)19-8-11-26-12-9-19/h1-13,15,17H,16H2,(H,28,31)/b20-13+