(5-methyl-4-oxidanylidene-2-propan-2-yl-1H-pyrimidin-6-yl)methanesulfonic acid

Systemtic Name: (5-methyl-4-oxidanylidene-2-propan-2-yl-1H-pyrimidin-6-yl)methanesulfonic acid Openeye Name: (2-isopropyl-5-methyl-4-oxo-1H-pyrimidin-6-yl)methanesulfonic acid CAS Name: (5-methyl-4-oxo-2-propan-2-yl-1H-pyrimidin-6-yl)methanesulfonic acid IUPAC Name: (5-methyl-4-oxo-2-propan-2-yl-1H-pyrimidin-6-yl)methanesulfonic acid Traditional Name: (2-isopropyl-4-keto-5-methyl-1H-pyrimidin-6-yl)methanesulfonic acid Formula: C9H14N2O4S MolecularWeight: 246.28346

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=NC1=O)C(C)C)CS(=O)(=O)O

Isomeric SMILES

CC1=C(NC(=NC1=O)C(C)C)CS(=O)(=O)O

InChI

InChI=1S/C9H14N2O4S/c1-5(2)8-10-7(4-16(13,14)15)6(3)9(12)11-8/h5H,4H2,1-3H3,(H,10,11,12)(H,13,14,15)