4-(4,6,6-trimethyl-2-sulfanylidene-1H-pyrimidin-3-yl)benzenesulfonamide

Systemtic Name: 4-(4,6,6-trimethyl-2-sulfanylidene-1H-pyrimidin-3-yl)benzenesulfonamide Openeye Name: 4-(4,6,6-trimethyl-2-thioxo-1H-pyrimidin-3-yl)benzenesulfonamide CAS Name: 4-(4,6,6-trimethyl-2-sulfanylidene-1H-pyrimidin-3-yl)benzenesulfonamide IUPAC Name: 4-(4,6,6-trimethyl-2-sulfanylidene-1H-pyrimidin-3-yl)benzenesulfonamide Traditional Name: 4-(4,6,6-trimethyl-2-thioxo-1H-pyrimidin-3-yl)benzenesulfonamide Formula: C13H17N3O2S2 MolecularWeight: 311.42298

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(NC(=S)N1C2=CC=C(C=C2)S(=O)(=O)N)(C)C

Isomeric SMILES

CC1=CC(NC(=S)N1C2=CC=C(C=C2)S(=O)(=O)N)(C)C

InChI

InChI=1S/C13H17N3O2S2/c1-9-8-13(2,3)15-12(19)16(9)10-4-6-11(7-5-10)20(14,17)18/h4-8H,1-3H3,(H,15,19)(H2,14,17,18)