4-butyl-1H-1,2,4-triazole-5-thione; 2,2,2-tris(chloranyl)ethanol

Systemtic Name: 4-butyl-1H-1,2,4-triazole-5-thione; 2,2,2-tris(chloranyl)ethanol Openeye Name: 4-butyl-1H-1,2,4-triazole-5-thione; 2,2,2-trichloroethanol CAS Name: 4-butyl-1H-1,2,4-triazole-5-thione; 2,2,2-trichloroethanol IUPAC Name: 4-butyl-1H-1,2,4-triazole-5-thione; 2,2,2-trichloroethanol Traditional Name: 4-butyl-1H-1,2,4-triazole-5-thione; 2,2,2-trichloroethanol Formula: C8H14Cl3N3OS MolecularWeight: 306.64026

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C=NNC1=S.C(C(Cl)(Cl)Cl)O

Isomeric SMILES

CCCCN1C=NNC1=S.C(C(Cl)(Cl)Cl)O

InChI

InChI=1S/C6H11N3S.C2H3Cl3O/c1-2-3-4-9-5-7-8-6(9)10;3-2(4,5)1-6/h5H,2-4H2,1H3,(H,8,10);6H,1H2