benzenesulfonic acid; methyl N'-carbamothioylcarbamimidothioate

Systemtic Name: benzenesulfonic acid; methyl N'-carbamothioylcarbamimidothioate Openeye Name: [amino(methylsulfanyl)methylene]thiourea; benzenesulfonic acid CAS Name: benzenesulfonic acid; N'-carbamothioylcarbamimidothioic acid methyl ester IUPAC Name: benzenesulfonic acid; methyl N'-carbamothioylcarbamimidothioate Traditional Name: [amino-(methylthio)methylene]thiourea; besylic acid Formula: C9H13N3O3S3 MolecularWeight: 307.41282

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Descriptors Computed from Structure

Canonical SMILES:

CSC(=NC(=S)N)N.C1=CC=C(C=C1)S(=O)(=O)O

Isomeric SMILES

CSC(=NC(=S)N)N.C1=CC=C(C=C1)S(=O)(=O)O

InChI

InChI=1S/C6H6O3S.C3H7N3S2/c7-10(8,9)6-4-2-1-3-5-6;1-8-3(5)6-2(4)7/h1-5H,(H,7,8,9);1H3,(H4,4,5,6,7)