4-butyl-3-heptyl-1H-1,2,4-triazole-5-thione

Systemtic Name: 4-butyl-3-heptyl-1H-1,2,4-triazole-5-thione Openeye Name: 4-butyl-3-heptyl-1H-1,2,4-triazole-5-thione CAS Name: 4-butyl-3-heptyl-1H-1,2,4-triazole-5-thione IUPAC Name: 4-butyl-3-heptyl-1H-1,2,4-triazole-5-thione Traditional Name: 4-butyl-3-heptyl-1H-1,2,4-triazole-5-thione Formula: C13H25N3S MolecularWeight: 255.4227

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=NNC(=S)N1CCCC

Isomeric SMILES

CCCCCCCC1=NNC(=S)N1CCCC

InChI

InChI=1S/C13H25N3S/c1-3-5-7-8-9-10-12-14-15-13(17)16(12)11-6-4-2/h3-11H2,1-2H3,(H,15,17)