2-methyl-4-[(phenylmethyl)amino]pyrimidine-5-carboxylate

Systemtic Name: 2-methyl-4-[(phenylmethyl)amino]pyrimidine-5-carboxylate Openeye Name: 4-(benzylamino)-2-methyl-pyrimidine-5-carboxylate CAS Name: 2-methyl-4-[(phenylmethyl)amino]-5-pyrimidinecarboxylate IUPAC Name: 4-(benzylamino)-2-methylpyrimidine-5-carboxylate Traditional Name: 4-(benzylamino)-2-methyl-pyrimidine-5-carboxylate Formula: C13H12N3O2- MolecularWeight: 242.25328

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(C(=N1)NCC2=CC=CC=C2)C(=O)[O-]

Isomeric SMILES

CC1=NC=C(C(=N1)NCC2=CC=CC=C2)C(=O)[O-]

InChI

InChI=1S/C13H13N3O2/c1-9-14-8-11(13(17)18)12(16-9)15-7-10-5-3-2-4-6-10/h2-6,8H,7H2,1H3,(H,17,18)(H,14,15,16)/p-1