N-[(4-chlorophenyl)methyl]-2-[[5-(4-methoxyphenyl)sulfonyl-6-oxidanylidene-1H-pyrimidin-2-yl]sulfanyl]ethanamide

Systemtic Name: N-[(4-chlorophenyl)methyl]-2-[[5-(4-methoxyphenyl)sulfonyl-6-oxidanylidene-1H-pyrimidin-2-yl]sulfanyl]ethanamide Openeye Name: N-[(4-chlorophenyl)methyl]-2-[[5-(4-methoxyphenyl)sulfonyl-6-oxo-1H-pyrimidin-2-yl]sulfanyl]acetamide CAS Name: N-[(4-chlorophenyl)methyl]-2-[[5-(4-methoxyphenyl)sulfonyl-6-oxo-1H-pyrimidin-2-yl]thio]acetamide IUPAC Name: N-[(4-chlorophenyl)methyl]-2-[[5-(4-methoxyphenyl)sulfonyl-6-oxo-1H-pyrimidin-2-yl]sulfanyl]acetamide Traditional Name: N-(4-chlorobenzyl)-2-[[6-keto-5-(4-methoxyphenyl)sulfonyl-1H-pyrimidin-2-yl]thio]acetamide Formula: C20H18ClN3O5S2 MolecularWeight: 479.95702

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)C2=CN=C(NC2=O)SCC(=O)NCC3=CC=C(C=C3)Cl

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)C2=CN=C(NC2=O)SCC(=O)NCC3=CC=C(C=C3)Cl

InChI

InChI=1S/C20H18ClN3O5S2/c1-29-15-6-8-16(9-7-15)31(27,28)17-11-23-20(24-19(17)26)30-12-18(25)22-10-13-2-4-14(21)5-3-13/h2-9,11H,10,12H2,1H3,(H,22,25)(H,23,24,26)