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

Systemtic Name: (E)-2-cyano-3-(1-phenyl-3-pyridin-4-yl-pyrazol-4-yl)-N-propan-2-yl-prop-2-enamide Openeye Name: (E)-2-cyano-N-isopropyl-3-[1-phenyl-3-(4-pyridyl)pyrazol-4-yl]prop-2-enamide CAS Name: (E)-2-cyano-3-(1-phenyl-3-pyridin-4-yl-4-pyrazolyl)-N-propan-2-yl-2-propenamide IUPAC Name: (E)-2-cyano-3-(1-phenyl-3-pyridin-4-ylpyrazol-4-yl)-N-propan-2-ylprop-2-enamide Traditional Name: (E)-2-cyano-N-isopropyl-3-[1-phenyl-3-(4-pyridyl)pyrazol-4-yl]acrylamide Formula: C21H19N5O MolecularWeight: 357.40846

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)C(=CC1=CN(N=C1C2=CC=NC=C2)C3=CC=CC=C3)C#N

Isomeric SMILES

CC(C)NC(=O)/C(=C/C1=CN(N=C1C2=CC=NC=C2)C3=CC=CC=C3)/C#N

InChI

InChI=1S/C21H19N5O/c1-15(2)24-21(27)17(13-22)12-18-14-26(19-6-4-3-5-7-19)25-20(18)16-8-10-23-11-9-16/h3-12,14-15H,1-2H3,(H,24,27)/b17-12+