4-carbamimidoylsulfanylbut-2-ynyl carbamimidothioate dihydrochloride

Systemtic Name: 4-carbamimidoylsulfanylbut-2-ynyl carbamimidothioate dihydrochloride Openeye Name: 2-(4-carbamimidoylsulfanylbut-2-ynyl)isothiourea dihydrochloride CAS Name: carbamimidothioic acid 4-(carbamimidoylthio)but-2-ynyl ester dihydrochloride IUPAC Name: 4-carbamimidoylsulfanylbut-2-ynyl carbamimidothioate dihydrochloride Traditional Name: 2-[4-(amidinothio)but-2-ynyl]isothiourea dihydrochloride Formula: C6H12Cl2N4S2 MolecularWeight: 275.22228

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Descriptors Computed from Structure

Canonical SMILES:

C(C#CCSC(=N)N)SC(=N)N.Cl.Cl

Isomeric SMILES

C(C#CCSC(=N)N)SC(=N)N.Cl.Cl

InChI

InChI=1S/C6H10N4S2.2ClH/c7-5(8)11-3-1-2-4-12-6(9)10;;/h3-4H2,(H3,7,8)(H3,9,10);2*1H