[4-(2-phenylpropan-2-yl)phenyl] 1,3-dimethyl-2,4-bis(oxidanylidene)pyrimidine-5-sulfonate

Systemtic Name: [4-(2-phenylpropan-2-yl)phenyl] 1,3-dimethyl-2,4-bis(oxidanylidene)pyrimidine-5-sulfonate Openeye Name: [4-(1-methyl-1-phenyl-ethyl)phenyl] 1,3-dimethyl-2,4-dioxo-pyrimidine-5-sulfonate CAS Name: 1,3-dimethyl-2,4-dioxo-5-pyrimidinesulfonic acid [4-(2-phenylpropan-2-yl)phenyl] ester IUPAC Name: [4-(2-phenylpropan-2-yl)phenyl] 1,3-dimethyl-2,4-dioxopyrimidine-5-sulfonate Traditional Name: 2,4-diketo-1,3-dimethyl-pyrimidine-5-sulfonic acid (4-cumylphenyl) ester Formula: C21H22N2O5S MolecularWeight: 414.47478

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1=CC=CC=C1)C2=CC=C(C=C2)OS(=O)(=O)C3=CN(C(=O)N(C3=O)C)C

Isomeric SMILES

CC(C)(C1=CC=CC=C1)C2=CC=C(C=C2)OS(=O)(=O)C3=CN(C(=O)N(C3=O)C)C

InChI

InChI=1S/C21H22N2O5S/c1-21(2,15-8-6-5-7-9-15)16-10-12-17(13-11-16)28-29(26,27)18-14-22(3)20(25)23(4)19(18)24/h5-14H,1-4H3