(6-oxidanylidene-1,2-diphenyl-pyrimidin-4-yl) 3-methoxy-2-methyl-4-methylsulfonyl-benzoate

Systemtic Name: (6-oxidanylidene-1,2-diphenyl-pyrimidin-4-yl) 3-methoxy-2-methyl-4-methylsulfonyl-benzoate Openeye Name: (6-oxo-1,2-diphenyl-pyrimidin-4-yl) 3-methoxy-2-methyl-4-methylsulfonyl-benzoate CAS Name: 3-methoxy-2-methyl-4-methylsulfonylbenzoic acid (6-oxo-1,2-diphenyl-4-pyrimidinyl) ester IUPAC Name: (6-oxo-1,2-diphenylpyrimidin-4-yl) 3-methoxy-2-methyl-4-methylsulfonylbenzoate Traditional Name: 4-mesyl-3-methoxy-2-methyl-benzoic acid (6-keto-1,2-diphenyl-pyrimidin-4-yl) ester Formula: C26H22N2O6S MolecularWeight: 490.52768

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1OC)S(=O)(=O)C)C(=O)OC2=CC(=O)N(C(=N2)C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC1=C(C=CC(=C1OC)S(=O)(=O)C)C(=O)OC2=CC(=O)N(C(=N2)C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C26H22N2O6S/c1-17-20(14-15-21(24(17)33-2)35(3,31)32)26(30)34-22-16-23(29)28(19-12-8-5-9-13-19)25(27-22)18-10-6-4-7-11-18/h4-16H,1-3H3