(5-methyl-2-propan-2-yl-phenyl) 1,3,4-trimethyl-2,6-bis(oxidanylidene)pyrimidine-5-sulfonate

Systemtic Name: (5-methyl-2-propan-2-yl-phenyl) 1,3,4-trimethyl-2,6-bis(oxidanylidene)pyrimidine-5-sulfonate Openeye Name: (2-isopropyl-5-methyl-phenyl) 1,3,4-trimethyl-2,6-dioxo-pyrimidine-5-sulfonate CAS Name: 1,3,4-trimethyl-2,6-dioxo-5-pyrimidinesulfonic acid (5-methyl-2-propan-2-ylphenyl) ester IUPAC Name: (5-methyl-2-propan-2-ylphenyl) 1,3,4-trimethyl-2,6-dioxopyrimidine-5-sulfonate Traditional Name: 2,4-diketo-1,3,6-trimethyl-pyrimidine-5-sulfonic acid (2-isopropyl-5-methyl-phenyl) ester Formula: C17H22N2O5S MolecularWeight: 366.43198

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(C)C)OS(=O)(=O)C2=C(N(C(=O)N(C2=O)C)C)C

Isomeric SMILES

CC1=CC(=C(C=C1)C(C)C)OS(=O)(=O)C2=C(N(C(=O)N(C2=O)C)C)C

InChI

InChI=1S/C17H22N2O5S/c1-10(2)13-8-7-11(3)9-14(13)24-25(22,23)15-12(4)18(5)17(21)19(6)16(15)20/h7-10H,1-6H3