[4-[(6-methylpyrimidin-4-yl)amino]phenyl] 3-methylbutanoate

Systemtic Name: [4-[(6-methylpyrimidin-4-yl)amino]phenyl] 3-methylbutanoate Openeye Name: [4-[(6-methylpyrimidin-4-yl)amino]phenyl] 3-methylbutanoate CAS Name: 3-methylbutanoic acid [4-[(6-methyl-4-pyrimidinyl)amino]phenyl] ester IUPAC Name: [4-[(6-methylpyrimidin-4-yl)amino]phenyl] 3-methylbutanoate Traditional Name: 3-methylbutyric acid [4-[(6-methylpyrimidin-4-yl)amino]phenyl] ester Formula: C16H19N3O2 MolecularWeight: 285.34096

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC=N1)NC2=CC=C(C=C2)OC(=O)CC(C)C

Isomeric SMILES

CC1=CC(=NC=N1)NC2=CC=C(C=C2)OC(=O)CC(C)C

InChI

InChI=1S/C16H19N3O2/c1-11(2)8-16(20)21-14-6-4-13(5-7-14)19-15-9-12(3)17-10-18-15/h4-7,9-11H,8H2,1-3H3,(H,17,18,19)