methyl 2-[(2-chloranyl-5-cyano-pyrimidin-4-yl)amino]-2-phenyl-ethanoate

Systemtic Name: methyl 2-[(2-chloranyl-5-cyano-pyrimidin-4-yl)amino]-2-phenyl-ethanoate Openeye Name: methyl 2-[(2-chloro-5-cyano-pyrimidin-4-yl)amino]-2-phenyl-acetate CAS Name: 2-[(2-chloro-5-cyano-4-pyrimidinyl)amino]-2-phenylacetic acid methyl ester IUPAC Name: methyl 2-[(2-chloro-5-cyanopyrimidin-4-yl)amino]-2-phenylacetate Traditional Name: 2-[(2-chloro-5-cyano-pyrimidin-4-yl)amino]-2-phenyl-acetic acid methyl ester Formula: C14H11ClN4O2 MolecularWeight: 302.71574

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C1=CC=CC=C1)NC2=NC(=NC=C2C#N)Cl

Isomeric SMILES

COC(=O)C(C1=CC=CC=C1)NC2=NC(=NC=C2C#N)Cl

InChI

InChI=1S/C14H11ClN4O2/c1-21-13(20)11(9-5-3-2-4-6-9)18-12-10(7-16)8-17-14(15)19-12/h2-6,8,11H,1H3,(H,17,18,19)