2-[(2-tert-butyl-1,2,4-triazol-3-yl)sulfanylmethyl]pyridine dihydrochloride

Systemtic Name: 2-[(2-tert-butyl-1,2,4-triazol-3-yl)sulfanylmethyl]pyridine dihydrochloride Openeye Name: 2-[(2-tert-butyl-1,2,4-triazol-3-yl)sulfanylmethyl]pyridine dihydrochloride CAS Name: 2-[[(2-tert-butyl-1,2,4-triazol-3-yl)thio]methyl]pyridine dihydrochloride IUPAC Name: 2-[(2-tert-butyl-1,2,4-triazol-3-yl)sulfanylmethyl]pyridine dihydrochloride Traditional Name: 2-[[(2-tert-butyl-1,2,4-triazol-3-yl)thio]methyl]pyridine dihydrochloride Formula: C12H18Cl2N4S MolecularWeight: 321.26912

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N1C(=NC=N1)SCC2=CC=CC=N2.Cl.Cl

Isomeric SMILES

CC(C)(C)N1C(=NC=N1)SCC2=CC=CC=N2.Cl.Cl

InChI

InChI=1S/C12H16N4S.2ClH/c1-12(2,3)16-11(14-9-15-16)17-8-10-6-4-5-7-13-10;;/h4-7,9H,8H2,1-3H3;2*1H