(3-methyl-2-sulfanyl-1H-imidazol-3-ium-4-yl)methanol

Systemtic Name: (3-methyl-2-sulfanyl-1H-imidazol-3-ium-4-yl)methanol Openeye Name: (3-methyl-2-sulfanyl-1H-imidazol-3-ium-4-yl)methanol CAS Name: (2-mercapto-3-methyl-1H-imidazol-3-ium-4-yl)methanol IUPAC Name: (3-methyl-2-sulfanyl-1H-imidazol-3-ium-4-yl)methanol Traditional Name: (2-mercapto-3-methyl-1H-imidazol-3-ium-4-yl)methanol Formula: C5H9N2OS+ MolecularWeight: 145.20276

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=C(NC=C1CO)S

Isomeric SMILES

C[N+]1=C(NC=C1CO)S

InChI

InChI=1S/C5H8N2OS/c1-7-4(3-8)2-6-5(7)9/h2,8H,3H2,1H3,(H,6,9)/p+1