1-(propylamino)-3-(1H-1,2,4-triazol-5-ylsulfanyl)propan-2-ol

Systemtic Name: 1-(propylamino)-3-(1H-1,2,4-triazol-5-ylsulfanyl)propan-2-ol Openeye Name: 1-(propylamino)-3-(1H-1,2,4-triazol-5-ylsulfanyl)propan-2-ol CAS Name: 1-(propylamino)-3-(1H-1,2,4-triazol-5-ylthio)-2-propanol IUPAC Name: 1-(propylamino)-3-(1H-1,2,4-triazol-5-ylsulfanyl)propan-2-ol Traditional Name: 1-(propylamino)-3-(1H-1,2,4-triazol-5-ylthio)propan-2-ol Formula: C8H16N4OS MolecularWeight: 216.30384

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Descriptors Computed from Structure

Canonical SMILES:

CCCNCC(CSC1=NC=NN1)O

Isomeric SMILES

CCCNCC(CSC1=NC=NN1)O

InChI

InChI=1S/C8H16N4OS/c1-2-3-9-4-7(13)5-14-8-10-6-11-12-8/h6-7,9,13H,2-5H2,1H3,(H,10,11,12)