5-(4-bromanyl-3-methyl-1,2-thiazol-5-yl)-1,2-dihydro-1,2,4-triazole-3-thione

Systemtic Name: 5-(4-bromanyl-3-methyl-1,2-thiazol-5-yl)-1,2-dihydro-1,2,4-triazole-3-thione Openeye Name: 5-(4-bromo-3-methyl-isothiazol-5-yl)-1,2-dihydro-1,2,4-triazole-3-thione CAS Name: 5-(4-bromo-3-methyl-5-isothiazolyl)-1,2-dihydro-1,2,4-triazole-3-thione IUPAC Name: 5-(4-bromo-3-methyl-1,2-thiazol-5-yl)-1,2-dihydro-1,2,4-triazole-3-thione Traditional Name: 5-(4-bromo-3-methyl-isothiazol-5-yl)-1,2-dihydro-1,2,4-triazole-3-thione Formula: C6H5BrN4S2 MolecularWeight: 277.1647

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NSC(=C1Br)C2=NC(=S)NN2

Isomeric SMILES

CC1=NSC(=C1Br)C2=NC(=S)NN2

InChI

InChI=1S/C6H5BrN4S2/c1-2-3(7)4(13-11-2)5-8-6(12)10-9-5/h1H3,(H2,8,9,10,12)