3-(4,6-dimethoxypyrimidin-2-yl)oxy-4-methoxy-4,4-diphenyl-1-(phenylsulfonyl)butan-2-one

Systemtic Name: 3-(4,6-dimethoxypyrimidin-2-yl)oxy-4-methoxy-4,4-diphenyl-1-(phenylsulfonyl)butan-2-one Openeye Name: 1-(benzenesulfonyl)-3-(4,6-dimethoxypyrimidin-2-yl)oxy-4-methoxy-4,4-diphenyl-butan-2-one CAS Name: 1-(benzenesulfonyl)-3-[(4,6-dimethoxy-2-pyrimidinyl)oxy]-4-methoxy-4,4-diphenyl-2-butanone IUPAC Name: 1-(benzenesulfonyl)-3-(4,6-dimethoxypyrimidin-2-yl)oxy-4-methoxy-4,4-diphenylbutan-2-one Traditional Name: 1-besyl-3-(4,6-dimethoxypyrimidin-2-yl)oxy-4-methoxy-4,4-diphenyl-butan-2-one Formula: C29H28N2O7S MolecularWeight: 548.60682

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=NC(=N1)OC(C(=O)CS(=O)(=O)C2=CC=CC=C2)C(C3=CC=CC=C3)(C4=CC=CC=C4)OC)OC

Isomeric SMILES

COC1=CC(=NC(=N1)OC(C(=O)CS(=O)(=O)C2=CC=CC=C2)C(C3=CC=CC=C3)(C4=CC=CC=C4)OC)OC

InChI

InChI=1S/C29H28N2O7S/c1-35-25-19-26(36-2)31-28(30-25)38-27(24(32)20-39(33,34)23-17-11-6-12-18-23)29(37-3,21-13-7-4-8-14-21)22-15-9-5-10-16-22/h4-19,27H,20H2,1-3H3