methyl N'-(4-aminophenyl)sulfonyl-N-thiophen-2-ylsulfonyl-carbamimidothioate

Systemtic Name: methyl N'-(4-aminophenyl)sulfonyl-N-thiophen-2-ylsulfonyl-carbamimidothioate Openeye Name: 3-(4-aminophenyl)sulfonyl-2-methyl-1-(2-thienylsulfonyl)isothiourea CAS Name: N'-(4-aminophenyl)sulfonyl-N-thiophen-2-ylsulfonylcarbamimidothioic acid methyl ester IUPAC Name: methyl N'-(4-aminophenyl)sulfonyl-N-thiophen-2-ylsulfonylcarbamimidothioate Traditional Name: 2-methyl-3-sulfanilyl-1-(2-thienylsulfonyl)isothiourea Formula: C12H13N3O4S4 MolecularWeight: 391.50932

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Descriptors Computed from Structure

Canonical SMILES:

CSC(=NS(=O)(=O)C1=CC=C(C=C1)N)NS(=O)(=O)C2=CC=CS2

Isomeric SMILES

CS/C(=N\S(=O)(=O)C1=CC=C(C=C1)N)/NS(=O)(=O)C2=CC=CS2

InChI

InChI=1S/C12H13N3O4S4/c1-20-12(15-23(18,19)11-3-2-8-21-11)14-22(16,17)10-6-4-9(13)5-7-10/h2-8H,13H2,1H3,(H,14,15)