2-hydroxyethyl 2-[(4-azanyl-5-cyano-pyrimidin-2-yl)amino]benzoate

Systemtic Name: 2-hydroxyethyl 2-[(4-azanyl-5-cyano-pyrimidin-2-yl)amino]benzoate Openeye Name: 2-hydroxyethyl 2-[(4-amino-5-cyano-pyrimidin-2-yl)amino]benzoate CAS Name: 2-[(4-amino-5-cyano-2-pyrimidinyl)amino]benzoic acid 2-hydroxyethyl ester IUPAC Name: 2-hydroxyethyl 2-[(4-amino-5-cyanopyrimidin-2-yl)amino]benzoate Traditional Name: 2-[(4-amino-5-cyano-pyrimidin-2-yl)amino]benzoic acid 2-hydroxyethyl ester Formula: C14H13N5O3 MolecularWeight: 299.28472

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)OCCO)NC2=NC=C(C(=N2)N)C#N

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)OCCO)NC2=NC=C(C(=N2)N)C#N

InChI

InChI=1S/C14H13N5O3/c15-7-9-8-17-14(19-12(9)16)18-11-4-2-1-3-10(11)13(21)22-6-5-20/h1-4,8,20H,5-6H2,(H3,16,17,18,19)