5-[1-(4-methylphenyl)-2-(phenylsulfonyl)ethyl]-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: 5-[1-(4-methylphenyl)-2-(phenylsulfonyl)ethyl]-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 5-[2-(benzenesulfonyl)-1-(p-tolyl)ethyl]-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 5-[2-(benzenesulfonyl)-1-(4-methylphenyl)ethyl]-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 5-[2-(benzenesulfonyl)-1-(4-methylphenyl)ethyl]-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 5-[2-besyl-1-(p-tolyl)ethyl]-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C19H18N2O4S2 MolecularWeight: 402.48722

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(CS(=O)(=O)C2=CC=CC=C2)C3C(=O)NC(=S)NC3=O

Isomeric SMILES

CC1=CC=C(C=C1)C(CS(=O)(=O)C2=CC=CC=C2)C3C(=O)NC(=S)NC3=O

InChI

InChI=1S/C19H18N2O4S2/c1-12-7-9-13(10-8-12)15(16-17(22)20-19(26)21-18(16)23)11-27(24,25)14-5-3-2-4-6-14/h2-10,15-16H,11H2,1H3,(H2,20,21,22,23,26)