2-[[5-(2,5-dimethylphenyl)sulfonyl-6-oxidanylidene-1H-pyrimidin-2-yl]sulfanyl]-N-(2-methylphenyl)ethanamide

Systemtic Name: 2-[[5-(2,5-dimethylphenyl)sulfonyl-6-oxidanylidene-1H-pyrimidin-2-yl]sulfanyl]-N-(2-methylphenyl)ethanamide Openeye Name: 2-[[5-(2,5-dimethylphenyl)sulfonyl-6-oxo-1H-pyrimidin-2-yl]sulfanyl]-N-(o-tolyl)acetamide CAS Name: 2-[[5-(2,5-dimethylphenyl)sulfonyl-6-oxo-1H-pyrimidin-2-yl]thio]-N-(2-methylphenyl)acetamide IUPAC Name: 2-[[5-(2,5-dimethylphenyl)sulfonyl-6-oxo-1H-pyrimidin-2-yl]sulfanyl]-N-(2-methylphenyl)acetamide Traditional Name: 2-[[5-(2,5-dimethylphenyl)sulfonyl-6-keto-1H-pyrimidin-2-yl]thio]-N-(o-tolyl)acetamide Formula: C21H21N3O4S2 MolecularWeight: 443.53914

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)S(=O)(=O)C2=CN=C(NC2=O)SCC(=O)NC3=CC=CC=C3C

Isomeric SMILES

CC1=CC(=C(C=C1)C)S(=O)(=O)C2=CN=C(NC2=O)SCC(=O)NC3=CC=CC=C3C

InChI

InChI=1S/C21H21N3O4S2/c1-13-8-9-15(3)17(10-13)30(27,28)18-11-22-21(24-20(18)26)29-12-19(25)23-16-7-5-4-6-14(16)2/h4-11H,12H2,1-3H3,(H,23,25)(H,22,24,26)