(E)-3-cyano-N-[4-methyl-3-[(4-pyridin-3-ylpyrimidin-2-yl)amino]phenyl]prop-2-enamide

Systemtic Name: (E)-3-cyano-N-[4-methyl-3-[(4-pyridin-3-ylpyrimidin-2-yl)amino]phenyl]prop-2-enamide Openeye Name: (E)-3-cyano-N-[4-methyl-3-[[4-(3-pyridyl)pyrimidin-2-yl]amino]phenyl]prop-2-enamide CAS Name: (E)-3-cyano-N-[4-methyl-3-[[4-(3-pyridinyl)-2-pyrimidinyl]amino]phenyl]-2-propenamide IUPAC Name: (E)-3-cyano-N-[4-methyl-3-[(4-pyridin-3-ylpyrimidin-2-yl)amino]phenyl]prop-2-enamide Traditional Name: (E)-3-cyano-N-[4-methyl-3-[[4-(3-pyridyl)pyrimidin-2-yl]amino]phenyl]acrylamide Formula: C20H16N6O MolecularWeight: 356.38064

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C=CC#N)NC2=NC=CC(=N2)C3=CN=CC=C3

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)/C=C/C#N)NC2=NC=CC(=N2)C3=CN=CC=C3

InChI

InChI=1S/C20H16N6O/c1-14-6-7-16(24-19(27)5-2-9-21)12-18(14)26-20-23-11-8-17(25-20)15-4-3-10-22-13-15/h2-8,10-13H,1H3,(H,24,27)(H,23,25,26)/b5-2+