4,6-dimethyl-1-(phenylsulfonyl)pyrimidin-2-one hydrochloride

Systemtic Name: 4,6-dimethyl-1-(phenylsulfonyl)pyrimidin-2-one hydrochloride Openeye Name: 1-(benzenesulfonyl)-4,6-dimethyl-pyrimidin-2-one hydrochloride CAS Name: 1-(benzenesulfonyl)-4,6-dimethyl-2-pyrimidinone hydrochloride IUPAC Name: 1-(benzenesulfonyl)-4,6-dimethylpyrimidin-2-one hydrochloride Traditional Name: 1-besyl-4,6-dimethyl-pyrimidin-2-one hydrochloride Formula: C12H13ClN2O3S MolecularWeight: 300.76122

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=O)N1S(=O)(=O)C2=CC=CC=C2)C.Cl

Isomeric SMILES

CC1=CC(=NC(=O)N1S(=O)(=O)C2=CC=CC=C2)C.Cl

InChI

InChI=1S/C12H12N2O3S.ClH/c1-9-8-10(2)14(12(15)13-9)18(16,17)11-6-4-3-5-7-11;/h3-8H,1-2H3;1H