[4-[(6-methylpyrimidin-4-yl)amino]phenyl] butanoate

Systemtic Name: [4-[(6-methylpyrimidin-4-yl)amino]phenyl] butanoate Openeye Name: [4-[(6-methylpyrimidin-4-yl)amino]phenyl] butanoate CAS Name: butanoic acid [4-[(6-methyl-4-pyrimidinyl)amino]phenyl] ester IUPAC Name: [4-[(6-methylpyrimidin-4-yl)amino]phenyl] butanoate Traditional Name: butyric acid [4-[(6-methylpyrimidin-4-yl)amino]phenyl] ester Formula: C15H17N3O2 MolecularWeight: 271.31438

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)OC1=CC=C(C=C1)NC2=NC=NC(=C2)C

Isomeric SMILES

CCCC(=O)OC1=CC=C(C=C1)NC2=NC=NC(=C2)C

InChI

InChI=1S/C15H17N3O2/c1-3-4-15(19)20-13-7-5-12(6-8-13)18-14-9-11(2)16-10-17-14/h5-10H,3-4H2,1-2H3,(H,16,17,18)