6-methyl-1H-pyrimidine-2-thione; 4-phenyl-1-sulfanyl-1,2,3-triazole; hydrochloride

Systemtic Name: 6-methyl-1H-pyrimidine-2-thione; 4-phenyl-1-sulfanyl-1,2,3-triazole; hydrochloride Openeye Name: 6-methyl-1H-pyrimidine-2-thione; 4-phenyl-1-sulfanyl-triazole; hydrochloride CAS Name: 1-mercapto-4-phenyltriazole; 6-methyl-1H-pyrimidine-2-thione; hydrochloride IUPAC Name: 6-methyl-1H-pyrimidine-2-thione; 4-phenyl-1-sulfanyltriazole; hydrochloride Traditional Name: 1-mercapto-4-phenyl-triazole; 6-methyl-1H-pyrimidine-2-thione; hydrochloride Formula: C13H14ClN5S2 MolecularWeight: 339.86676

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=NC(=S)N1.C1=CC=C(C=C1)C2=CN(N=N2)S.Cl

Isomeric SMILES

CC1=CC=NC(=S)N1.C1=CC=C(C=C1)C2=CN(N=N2)S.Cl

InChI

InChI=1S/C8H7N3S.C5H6N2S.ClH/c12-11-6-8(9-10-11)7-4-2-1-3-5-7;1-4-2-3-6-5(8)7-4;/h1-6,12H;2-3H,1H3,(H,6,7,8);1H