[6-methoxy-5-methyl-2-[(4-methylphenyl)sulfonyloxymethyl]pyrimidin-4-yl]methyl 4-methylbenzenesulfonate

Systemtic Name: [6-methoxy-5-methyl-2-[(4-methylphenyl)sulfonyloxymethyl]pyrimidin-4-yl]methyl 4-methylbenzenesulfonate Openeye Name: [6-methoxy-5-methyl-2-(p-tolylsulfonyloxymethyl)pyrimidin-4-yl]methyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [6-methoxy-5-methyl-2-[(4-methylphenyl)sulfonyloxymethyl]-4-pyrimidinyl]methyl ester IUPAC Name: [6-methoxy-5-methyl-2-[(4-methylphenyl)sulfonyloxymethyl]pyrimidin-4-yl]methyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [6-methoxy-5-methyl-2-(tosyloxymethyl)pyrimidin-4-yl]methyl ester Formula: C22H24N2O7S2 MolecularWeight: 492.56516

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCC2=C(C(=NC(=N2)COS(=O)(=O)C3=CC=C(C=C3)C)OC)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCC2=C(C(=NC(=N2)COS(=O)(=O)C3=CC=C(C=C3)C)OC)C

InChI

InChI=1S/C22H24N2O7S2/c1-15-5-9-18(10-6-15)32(25,26)30-13-20-17(3)22(29-4)24-21(23-20)14-31-33(27,28)19-11-7-16(2)8-12-19/h5-12H,13-14H2,1-4H3