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

Systemtic Name: (4-oxidanylidene-2-propan-2-yl-1H-pyrimidin-6-yl)methanesulfonic acid Openeye Name: (2-isopropyl-4-oxo-1H-pyrimidin-6-yl)methanesulfonic acid CAS Name: (4-oxo-2-propan-2-yl-1H-pyrimidin-6-yl)methanesulfonic acid IUPAC Name: (4-oxo-2-propan-2-yl-1H-pyrimidin-6-yl)methanesulfonic acid Traditional Name: (2-isopropyl-4-keto-1H-pyrimidin-6-yl)methanesulfonic acid Formula: C8H12N2O4S MolecularWeight: 232.25688

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NC(=O)C=C(N1)CS(=O)(=O)O

Isomeric SMILES

CC(C)C1=NC(=O)C=C(N1)CS(=O)(=O)O

InChI

InChI=1S/C8H12N2O4S/c1-5(2)8-9-6(3-7(11)10-8)4-15(12,13)14/h3,5H,4H2,1-2H3,(H,9,10,11)(H,12,13,14)