methyl N'-(2-chlorophenyl)sulfonyl-N-(4,6-dimethoxypyrimidin-2-yl)carbamimidothioate

Systemtic Name: methyl N'-(2-chlorophenyl)sulfonyl-N-(4,6-dimethoxypyrimidin-2-yl)carbamimidothioate Openeye Name: 3-(2-chlorophenyl)sulfonyl-1-(4,6-dimethoxypyrimidin-2-yl)-2-methyl-isothiourea CAS Name: N'-(2-chlorophenyl)sulfonyl-N-(4,6-dimethoxy-2-pyrimidinyl)carbamimidothioic acid methyl ester IUPAC Name: methyl N'-(2-chlorophenyl)sulfonyl-N-(4,6-dimethoxypyrimidin-2-yl)carbamimidothioate Traditional Name: 3-(2-chlorophenyl)sulfonyl-1-(4,6-dimethoxypyrimidin-2-yl)-2-methyl-isothiourea Formula: C14H15ClN4O4S2 MolecularWeight: 402.8763

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=NC(=N1)NC(=NS(=O)(=O)C2=CC=CC=C2Cl)SC)OC

Isomeric SMILES

COC1=CC(=NC(=N1)N/C(=N/S(=O)(=O)C2=CC=CC=C2Cl)/SC)OC

InChI

InChI=1S/C14H15ClN4O4S2/c1-22-11-8-12(23-2)17-13(16-11)18-14(24-3)19-25(20,21)10-7-5-4-6-9(10)15/h4-8H,1-3H3,(H,16,17,18,19)