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

Systemtic Name: [3-[(6-methylpyrimidin-4-yl)amino]phenyl] methanesulfonate Openeye Name: [3-[(6-methylpyrimidin-4-yl)amino]phenyl] methanesulfonate CAS Name: methanesulfonic acid [3-[(6-methyl-4-pyrimidinyl)amino]phenyl] ester IUPAC Name: [3-[(6-methylpyrimidin-4-yl)amino]phenyl] methanesulfonate Traditional Name: methanesulfonic acid [3-[(6-methylpyrimidin-4-yl)amino]phenyl] ester Formula: C12H13N3O3S MolecularWeight: 279.31492

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H13N3O3S/c1-9-6-12(14-8-13-9)15-10-4-3-5-11(7-10)18-19(2,16)17/h3-8H,1-2H3,(H,13,14,15)