2-[2-(2-methyl-5-nitro-imidazol-1-yl)ethylsulfanyl]ethanol

Systemtic Name: 2-[2-(2-methyl-5-nitro-imidazol-1-yl)ethylsulfanyl]ethanol Openeye Name: 2-[2-(2-methyl-5-nitro-imidazol-1-yl)ethylsulfanyl]ethanol CAS Name: 2-[2-(2-methyl-5-nitro-1-imidazolyl)ethylthio]ethanol IUPAC Name: 2-[2-(2-methyl-5-nitroimidazol-1-yl)ethylsulfanyl]ethanol Traditional Name: 2-[2-(2-methyl-5-nitro-imidazol-1-yl)ethylthio]ethanol Formula: C8H13N3O3S MolecularWeight: 231.27212

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(N1CCSCCO)[N+](=O)[O-]

Isomeric SMILES

CC1=NC=C(N1CCSCCO)[N+](=O)[O-]

InChI

InChI=1S/C8H13N3O3S/c1-7-9-6-8(11(13)14)10(7)2-4-15-5-3-12/h6,12H,2-5H2,1H3