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

Systemtic Name: methyl N'-(4-chlorophenyl)sulfonyl-N-cyano-carbamimidothioate Openeye Name: 3-(4-chlorophenyl)sulfonyl-1-cyano-2-methyl-isothiourea CAS Name: N'-(4-chlorophenyl)sulfonyl-N-cyanocarbamimidothioic acid methyl ester IUPAC Name: methyl N'-(4-chlorophenyl)sulfonyl-N-cyanocarbamimidothioate Traditional Name: 3-(4-chlorophenyl)sulfonyl-1-cyano-2-methyl-isothiourea Formula: C9H8ClN3O2S2 MolecularWeight: 289.76172

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Descriptors Computed from Structure

Canonical SMILES:

CSC(=NS(=O)(=O)C1=CC=C(C=C1)Cl)NC#N

Isomeric SMILES

CS/C(=N\S(=O)(=O)C1=CC=C(C=C1)Cl)/NC#N

InChI

InChI=1S/C9H8ClN3O2S2/c1-16-9(12-6-11)13-17(14,15)8-4-2-7(10)3-5-8/h2-5H,1H3,(H,12,13)