4-methyl-N-(4-oxidanylidene-2-phenacylsulfanyl-1H-pyrimidin-6-yl)benzenesulfonamide

Systemtic Name: 4-methyl-N-(4-oxidanylidene-2-phenacylsulfanyl-1H-pyrimidin-6-yl)benzenesulfonamide Openeye Name: 4-methyl-N-(4-oxo-2-phenacylsulfanyl-1H-pyrimidin-6-yl)benzenesulfonamide CAS Name: 4-methyl-N-[4-oxo-2-(phenacylthio)-1H-pyrimidin-6-yl]benzenesulfonamide IUPAC Name: 4-methyl-N-(4-oxo-2-phenacylsulfanyl-1H-pyrimidin-6-yl)benzenesulfonamide Traditional Name: N-[4-keto-2-(phenacylthio)-1H-pyrimidin-6-yl]-4-methyl-benzenesulfonamide Formula: C19H17N3O4S2 MolecularWeight: 415.48598

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC2=CC(=O)N=C(N2)SCC(=O)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC2=CC(=O)N=C(N2)SCC(=O)C3=CC=CC=C3

InChI

InChI=1S/C19H17N3O4S2/c1-13-7-9-15(10-8-13)28(25,26)22-17-11-18(24)21-19(20-17)27-12-16(23)14-5-3-2-4-6-14/h2-11H,12H2,1H3,(H2,20,21,22,24)