2-[2,3-bis(oxidanyl)propylsulfanyl]pyridine-4-carbothioamide

Systemtic Name: 2-[2,3-bis(oxidanyl)propylsulfanyl]pyridine-4-carbothioamide Openeye Name: 2-(2,3-dihydroxypropylsulfanyl)pyridine-4-carbothioamide CAS Name: 2-(2,3-dihydroxypropylthio)-4-pyridinecarbothioamide IUPAC Name: 2-(2,3-dihydroxypropylsulfanyl)pyridine-4-carbothioamide Traditional Name: 2-(glycerylthio)thioisonicotinamide Formula: C9H12N2O2S2 MolecularWeight: 244.33378

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN=C(C=C1C(=S)N)SCC(CO)O

Isomeric SMILES

C1=CN=C(C=C1C(=S)N)SCC(CO)O

InChI

InChI=1S/C9H12N2O2S2/c10-9(14)6-1-2-11-8(3-6)15-5-7(13)4-12/h1-3,7,12-13H,4-5H2,(H2,10,14)