methyl N-(4-chlorophenyl)-N'-(4-methylphenyl)sulfonyl-carbamimidothioate

Systemtic Name: methyl N-(4-chlorophenyl)-N'-(4-methylphenyl)sulfonyl-carbamimidothioate Openeye Name: 1-(4-chlorophenyl)-2-methyl-3-(p-tolylsulfonyl)isothiourea CAS Name: N-(4-chlorophenyl)-N'-(4-methylphenyl)sulfonylcarbamimidothioic acid methyl ester IUPAC Name: methyl N-(4-chlorophenyl)-N'-(4-methylphenyl)sulfonylcarbamimidothioate Traditional Name: 1-(4-chlorophenyl)-2-methyl-3-tosyl-isothiourea Formula: C15H15ClN2O2S2 MolecularWeight: 354.8748

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N=C(NC2=CC=C(C=C2)Cl)SC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)/N=C(/NC2=CC=C(C=C2)Cl)\SC

InChI

InChI=1S/C15H15ClN2O2S2/c1-11-3-9-14(10-4-11)22(19,20)18-15(21-2)17-13-7-5-12(16)6-8-13/h3-10H,1-2H3,(H,17,18)