(7-oxidanylidene-5-sulfanyl-thieno[3,2-b]thiopyran-6-yl)methyl carbamimidothioate

Systemtic Name: (7-oxidanylidene-5-sulfanyl-thieno[3,2-b]thiopyran-6-yl)methyl carbamimidothioate Openeye Name: 2-[(7-oxo-5-sulfanyl-thieno[3,2-b]thiopyran-6-yl)methyl]isothiourea CAS Name: carbamimidothioic acid (5-mercapto-7-oxo-6-thieno[3,2-b]thiopyranyl)methyl ester IUPAC Name: (7-oxo-5-sulfanylthieno[3,2-b]thiopyran-6-yl)methyl carbamimidothioate Traditional Name: 2-[(7-keto-5-mercapto-thieno[3,2-b]thiopyran-6-yl)methyl]isothiourea Formula: C9H8N2OS4 MolecularWeight: 288.43262

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC2=C1SC(=C(C2=O)CSC(=N)N)S

Isomeric SMILES

C1=CSC2=C1SC(=C(C2=O)CSC(=N)N)S

InChI

InChI=1S/C9H8N2OS4/c10-9(11)15-3-4-6(12)7-5(1-2-14-7)16-8(4)13/h1-2,13H,3H2,(H3,10,11)