(Z)-2-cyano-3-[(2-pyridin-4-ylpyrimidin-4-yl)amino]prop-2-enoic acid

Systemtic Name: (Z)-2-cyano-3-[(2-pyridin-4-ylpyrimidin-4-yl)amino]prop-2-enoic acid Openeye Name: (Z)-2-cyano-3-[[2-(4-pyridyl)pyrimidin-4-yl]amino]prop-2-enoic acid CAS Name: (Z)-2-cyano-3-[(2-pyridin-4-yl-4-pyrimidinyl)amino]-2-propenoic acid IUPAC Name: (Z)-2-cyano-3-[(2-pyridin-4-ylpyrimidin-4-yl)amino]prop-2-enoic acid Traditional Name: (Z)-2-cyano-3-[[2-(4-pyridyl)pyrimidin-4-yl]amino]acrylic acid Formula: C13H9N5O2 MolecularWeight: 267.24286

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN=CC=C1C2=NC=CC(=N2)NC=C(C#N)C(=O)O

Isomeric SMILES

C1=CN=CC=C1C2=NC=CC(=N2)N/C=C(/C#N)\C(=O)O

InChI

InChI=1S/C13H9N5O2/c14-7-10(13(19)20)8-17-11-3-6-16-12(18-11)9-1-4-15-5-2-9/h1-6,8H,(H,19,20)(H,16,17,18)/b10-8-