4-chloranyl-N-(5,5-dimethyl-4,6-dihydro-1H-pyrimidin-2-yl)-5-methyl-2-sulfanyl-benzenesulfonamide

Systemtic Name: 4-chloranyl-N-(5,5-dimethyl-4,6-dihydro-1H-pyrimidin-2-yl)-5-methyl-2-sulfanyl-benzenesulfonamide Openeye Name: 4-chloro-N-(5,5-dimethyl-4,6-dihydro-1H-pyrimidin-2-yl)-5-methyl-2-sulfanyl-benzenesulfonamide CAS Name: 4-chloro-N-(5,5-dimethyl-4,6-dihydro-1H-pyrimidin-2-yl)-2-mercapto-5-methylbenzenesulfonamide IUPAC Name: 4-chloro-N-(5,5-dimethyl-4,6-dihydro-1H-pyrimidin-2-yl)-5-methyl-2-sulfanylbenzenesulfonamide Traditional Name: 4-chloro-N-(5,5-dimethyl-4,6-dihydro-1H-pyrimidin-2-yl)-2-mercapto-5-methyl-benzenesulfonamide Formula: C13H18ClN3O2S2 MolecularWeight: 347.88392

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1Cl)S)S(=O)(=O)NC2=NCC(CN2)(C)C

Isomeric SMILES

CC1=CC(=C(C=C1Cl)S)S(=O)(=O)NC2=NCC(CN2)(C)C

InChI

InChI=1S/C13H18ClN3O2S2/c1-8-4-11(10(20)5-9(8)14)21(18,19)17-12-15-6-13(2,3)7-16-12/h4-5,20H,6-7H2,1-3H3,(H2,15,16,17)