3-hexylsulfanyl-5-methyl-1H-1,2,4-triazole

Systemtic Name: 3-hexylsulfanyl-5-methyl-1H-1,2,4-triazole Openeye Name: 3-hexylsulfanyl-5-methyl-1H-1,2,4-triazole CAS Name: 3-(hexylthio)-5-methyl-1H-1,2,4-triazole IUPAC Name: 3-hexylsulfanyl-5-methyl-1H-1,2,4-triazole Traditional Name: 3-(hexylthio)-5-methyl-1H-1,2,4-triazole Formula: C9H17N3S MolecularWeight: 199.31638

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCSC1=NNC(=N1)C

Isomeric SMILES

CCCCCCSC1=NNC(=N1)C

InChI

InChI=1S/C9H17N3S/c1-3-4-5-6-7-13-9-10-8(2)11-12-9/h3-7H2,1-2H3,(H,10,11,12)