4-(2-bromanyl-4-methyl-phenyl)-3-propyl-1H-1,2,4-triazole-5-thione

Systemtic Name: 4-(2-bromanyl-4-methyl-phenyl)-3-propyl-1H-1,2,4-triazole-5-thione Openeye Name: 4-(2-bromo-4-methyl-phenyl)-3-propyl-1H-1,2,4-triazole-5-thione CAS Name: 4-(2-bromo-4-methylphenyl)-3-propyl-1H-1,2,4-triazole-5-thione IUPAC Name: 4-(2-bromo-4-methylphenyl)-3-propyl-1H-1,2,4-triazole-5-thione Traditional Name: 4-(2-bromo-4-methyl-phenyl)-3-propyl-1H-1,2,4-triazole-5-thione Formula: C12H14BrN3S MolecularWeight: 312.22866

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NNC(=S)N1C2=C(C=C(C=C2)C)Br

Isomeric SMILES

CCCC1=NNC(=S)N1C2=C(C=C(C=C2)C)Br

InChI

InChI=1S/C12H14BrN3S/c1-3-4-11-14-15-12(17)16(11)10-6-5-8(2)7-9(10)13/h5-7H,3-4H2,1-2H3,(H,15,17)