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5-heptylsulfanyl-1H-1,2,4-triazole

5-heptylsulfanyl-1H-1,2,4-triazole

Systemtic Name:5-heptylsulfanyl-1H-1,2,4-triazole
Openeye Name:5-heptylsulfanyl-1H-1,2,4-triazole
CAS Name:5-(heptylthio)-1H-1,2,4-triazole
IUPAC Name:5-heptylsulfanyl-1H-1,2,4-triazole
Traditional Name:5-(heptylthio)-1H-1,2,4-triazole
Formula: C9H17N3S
MolecularWeight: 199.31638
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCSC1=NC=NN1


Isomeric SMILES

CCCCCCCSC1=NC=NN1


InChI

InChI=1S/C9H17N3S/c1-2-3-4-5-6-7-13-9-10-8-11-12-9/h8H,2-7H2,1H3,(H,10,11,12)


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