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

Systemtic Name: [3-[(6-phenylpyrimidin-4-yl)amino]phenyl] methanesulfonate Openeye Name: [3-[(6-phenylpyrimidin-4-yl)amino]phenyl] methanesulfonate CAS Name: methanesulfonic acid [3-[(6-phenyl-4-pyrimidinyl)amino]phenyl] ester IUPAC Name: [3-[(6-phenylpyrimidin-4-yl)amino]phenyl] methanesulfonate Traditional Name: methanesulfonic acid [3-[(6-phenylpyrimidin-4-yl)amino]phenyl] ester Formula: C17H15N3O3S MolecularWeight: 341.3843

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)OC1=CC=CC(=C1)NC2=NC=NC(=C2)C3=CC=CC=C3

Isomeric SMILES

CS(=O)(=O)OC1=CC=CC(=C1)NC2=NC=NC(=C2)C3=CC=CC=C3

InChI

InChI=1S/C17H15N3O3S/c1-24(21,22)23-15-9-5-8-14(10-15)20-17-11-16(18-12-19-17)13-6-3-2-4-7-13/h2-12H,1H3,(H,18,19,20)