(5-oxidanyl-4-oxidanylidene-pyran-2-yl)methyl carbamimidothioate

Systemtic Name: (5-oxidanyl-4-oxidanylidene-pyran-2-yl)methyl carbamimidothioate Openeye Name: 2-[(5-hydroxy-4-oxo-pyran-2-yl)methyl]isothiourea CAS Name: carbamimidothioic acid (5-hydroxy-4-oxo-2-pyranyl)methyl ester IUPAC Name: (5-hydroxy-4-oxopyran-2-yl)methyl carbamimidothioate Traditional Name: 2-[(5-hydroxy-4-keto-pyran-2-yl)methyl]isothiourea Formula: C7H8N2O3S MolecularWeight: 200.21502

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(OC=C(C1=O)O)CSC(=N)N

Isomeric SMILES

C1=C(OC=C(C1=O)O)CSC(=N)N

InChI

InChI=1S/C7H8N2O3S/c8-7(9)13-3-4-1-5(10)6(11)2-12-4/h1-2,11H,3H2,(H3,8,9)