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

Systemtic Name: methyl N-cyano-N'-(4-methoxyphenyl)sulfonyl-carbamimidothioate Openeye Name: 1-cyano-3-(4-methoxyphenyl)sulfonyl-2-methyl-isothiourea CAS Name: N-cyano-N'-(4-methoxyphenyl)sulfonylcarbamimidothioic acid methyl ester IUPAC Name: methyl N-cyano-N'-(4-methoxyphenyl)sulfonylcarbamimidothioate Traditional Name: 1-cyano-3-(4-methoxyphenyl)sulfonyl-2-methyl-isothiourea Formula: C10H11N3O3S2 MolecularWeight: 285.34264

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)N=C(NC#N)SC

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)/N=C(/NC#N)\SC

InChI

InChI=1S/C10H11N3O3S2/c1-16-8-3-5-9(6-4-8)18(14,15)13-10(17-2)12-7-11/h3-6H,1-2H3,(H,12,13)