methyl 2-[(5-azanyl-6-chloranyl-pyrimidin-4-yl)-methyl-amino]benzoate

Systemtic Name: methyl 2-[(5-azanyl-6-chloranyl-pyrimidin-4-yl)-methyl-amino]benzoate Openeye Name: methyl 2-[(5-amino-6-chloro-pyrimidin-4-yl)-methyl-amino]benzoate CAS Name: 2-[(5-amino-6-chloro-4-pyrimidinyl)-methylamino]benzoic acid methyl ester IUPAC Name: methyl 2-[(5-amino-6-chloropyrimidin-4-yl)-methylamino]benzoate Traditional Name: 2-[(5-amino-6-chloro-pyrimidin-4-yl)-methyl-amino]benzoic acid methyl ester Formula: C13H13ClN4O2 MolecularWeight: 292.72092

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=CC=C1C(=O)OC)C2=C(C(=NC=N2)Cl)N

Isomeric SMILES

CN(C1=CC=CC=C1C(=O)OC)C2=C(C(=NC=N2)Cl)N

InChI

InChI=1S/C13H13ClN4O2/c1-18(12-10(15)11(14)16-7-17-12)9-6-4-3-5-8(9)13(19)20-2/h3-7H,15H2,1-2H3