propyl 3-[(6-methylpyrimidin-4-yl)amino]benzoate

Systemtic Name: propyl 3-[(6-methylpyrimidin-4-yl)amino]benzoate Openeye Name: propyl 3-[(6-methylpyrimidin-4-yl)amino]benzoate CAS Name: 3-[(6-methyl-4-pyrimidinyl)amino]benzoic acid propyl ester IUPAC Name: propyl 3-[(6-methylpyrimidin-4-yl)amino]benzoate Traditional Name: 3-[(6-methylpyrimidin-4-yl)amino]benzoic acid propyl ester Formula: C15H17N3O2 MolecularWeight: 271.31438

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=CC(=CC=C1)NC2=NC=NC(=C2)C

Isomeric SMILES

CCCOC(=O)C1=CC(=CC=C1)NC2=NC=NC(=C2)C

InChI

InChI=1S/C15H17N3O2/c1-3-7-20-15(19)12-5-4-6-13(9-12)18-14-8-11(2)16-10-17-14/h4-6,8-10H,3,7H2,1-2H3,(H,16,17,18)