methyl-[(2S)-2-oxidanyl-3-(1H-1,2,4-triazol-5-ylsulfanyl)propyl]azanium

Systemtic Name: methyl-[(2S)-2-oxidanyl-3-(1H-1,2,4-triazol-5-ylsulfanyl)propyl]azanium Openeye Name: [(2S)-2-hydroxy-3-(1H-1,2,4-triazol-5-ylsulfanyl)propyl]-methyl-ammonium CAS Name: [(2S)-2-hydroxy-3-(1H-1,2,4-triazol-5-ylthio)propyl]-methylammonium IUPAC Name: [(2S)-2-hydroxy-3-(1H-1,2,4-triazol-5-ylsulfanyl)propyl]-methylazanium Traditional Name: [(2S)-2-hydroxy-3-(1H-1,2,4-triazol-5-ylthio)propyl]-methyl-ammonium Formula: C6H13N4OS+ MolecularWeight: 189.25862

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Descriptors Computed from Structure

Canonical SMILES:

C[NH2+]CC(CSC1=NC=NN1)O

Isomeric SMILES

C[NH2+]C[C@@H](CSC1=NC=NN1)O

InChI

InChI=1S/C6H12N4OS/c1-7-2-5(11)3-12-6-8-4-9-10-6/h4-5,7,11H,2-3H2,1H3,(H,8,9,10)/p+1/t5-/m0/s1