2-[[5-(3-chloranyl-4-methyl-phenyl)sulfonyl-6-oxidanylidene-1H-pyrimidin-2-yl]sulfanyl]-N-[(4-methylphenyl)methyl]ethanamide

Systemtic Name: 2-[[5-(3-chloranyl-4-methyl-phenyl)sulfonyl-6-oxidanylidene-1H-pyrimidin-2-yl]sulfanyl]-N-[(4-methylphenyl)methyl]ethanamide Openeye Name: 2-[[5-(3-chloro-4-methyl-phenyl)sulfonyl-6-oxo-1H-pyrimidin-2-yl]sulfanyl]-N-(p-tolylmethyl)acetamide CAS Name: 2-[[5-(3-chloro-4-methylphenyl)sulfonyl-6-oxo-1H-pyrimidin-2-yl]thio]-N-[(4-methylphenyl)methyl]acetamide IUPAC Name: 2-[[5-(3-chloro-4-methylphenyl)sulfonyl-6-oxo-1H-pyrimidin-2-yl]sulfanyl]-N-[(4-methylphenyl)methyl]acetamide Traditional Name: 2-[[5-(3-chloro-4-methyl-phenyl)sulfonyl-6-keto-1H-pyrimidin-2-yl]thio]-N-(4-methylbenzyl)acetamide Formula: C21H20ClN3O4S2 MolecularWeight: 477.9842

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC(=O)CSC2=NC=C(C(=O)N2)S(=O)(=O)C3=CC(=C(C=C3)C)Cl

Isomeric SMILES

CC1=CC=C(C=C1)CNC(=O)CSC2=NC=C(C(=O)N2)S(=O)(=O)C3=CC(=C(C=C3)C)Cl

InChI

InChI=1S/C21H20ClN3O4S2/c1-13-3-6-15(7-4-13)10-23-19(26)12-30-21-24-11-18(20(27)25-21)31(28,29)16-8-5-14(2)17(22)9-16/h3-9,11H,10,12H2,1-2H3,(H,23,26)(H,24,25,27)