ethyl (E)-3-cyano-3-[(2-pyridin-4-ylpyrimidin-4-yl)amino]prop-2-enoate

Systemtic Name: ethyl (E)-3-cyano-3-[(2-pyridin-4-ylpyrimidin-4-yl)amino]prop-2-enoate Openeye Name: ethyl (E)-3-cyano-3-[[2-(4-pyridyl)pyrimidin-4-yl]amino]prop-2-enoate CAS Name: (E)-3-cyano-3-[(2-pyridin-4-yl-4-pyrimidinyl)amino]-2-propenoic acid ethyl ester IUPAC Name: ethyl (E)-3-cyano-3-[(2-pyridin-4-ylpyrimidin-4-yl)amino]prop-2-enoate Traditional Name: (E)-3-cyano-3-[[2-(4-pyridyl)pyrimidin-4-yl]amino]acrylic acid ethyl ester Formula: C15H13N5O2 MolecularWeight: 295.29602

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=C(C#N)NC1=NC(=NC=C1)C2=CC=NC=C2

Isomeric SMILES

CCOC(=O)/C=C(\C#N)/NC1=NC(=NC=C1)C2=CC=NC=C2

InChI

InChI=1S/C15H13N5O2/c1-2-22-14(21)9-12(10-16)19-13-5-8-18-15(20-13)11-3-6-17-7-4-11/h3-9H,2H2,1H3,(H,18,19,20)/b12-9+