2-[[5-(3,4-dimethylphenyl)sulfonyl-6-oxidanylidene-1H-pyrimidin-2-yl]sulfanyl]-N-(3-methoxyphenyl)ethanamide

Systemtic Name: 2-[[5-(3,4-dimethylphenyl)sulfonyl-6-oxidanylidene-1H-pyrimidin-2-yl]sulfanyl]-N-(3-methoxyphenyl)ethanamide Openeye Name: 2-[[5-(3,4-dimethylphenyl)sulfonyl-6-oxo-1H-pyrimidin-2-yl]sulfanyl]-N-(3-methoxyphenyl)acetamide CAS Name: 2-[[5-(3,4-dimethylphenyl)sulfonyl-6-oxo-1H-pyrimidin-2-yl]thio]-N-(3-methoxyphenyl)acetamide IUPAC Name: 2-[[5-(3,4-dimethylphenyl)sulfonyl-6-oxo-1H-pyrimidin-2-yl]sulfanyl]-N-(3-methoxyphenyl)acetamide Traditional Name: 2-[[5-(3,4-dimethylphenyl)sulfonyl-6-keto-1H-pyrimidin-2-yl]thio]-N-(3-methoxyphenyl)acetamide Formula: C21H21N3O5S2 MolecularWeight: 459.53854

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)C2=CN=C(NC2=O)SCC(=O)NC3=CC(=CC=C3)OC)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)C2=CN=C(NC2=O)SCC(=O)NC3=CC(=CC=C3)OC)C

InChI

InChI=1S/C21H21N3O5S2/c1-13-7-8-17(9-14(13)2)31(27,28)18-11-22-21(24-20(18)26)30-12-19(25)23-15-5-4-6-16(10-15)29-3/h4-11H,12H2,1-3H3,(H,23,25)(H,22,24,26)