3-heptan-3-yl-4-methyl-1H-1,2,4-triazole-5-thione

Systemtic Name: 3-heptan-3-yl-4-methyl-1H-1,2,4-triazole-5-thione Openeye Name: 3-(1-ethylpentyl)-4-methyl-1H-1,2,4-triazole-5-thione CAS Name: 3-heptan-3-yl-4-methyl-1H-1,2,4-triazole-5-thione IUPAC Name: 3-heptan-3-yl-4-methyl-1H-1,2,4-triazole-5-thione Traditional Name: 3-(1-ethylpentyl)-4-methyl-1H-1,2,4-triazole-5-thione Formula: C10H19N3S MolecularWeight: 213.34296

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)C1=NNC(=S)N1C

Isomeric SMILES

CCCCC(CC)C1=NNC(=S)N1C

InChI

InChI=1S/C10H19N3S/c1-4-6-7-8(5-2)9-11-12-10(14)13(9)3/h8H,4-7H2,1-3H3,(H,12,14)