3-(4-bromophenyl)-4-(furan-2-ylmethyl)-1H-1,2,4-triazole-5-thione

Systemtic Name: 3-(4-bromophenyl)-4-(furan-2-ylmethyl)-1H-1,2,4-triazole-5-thione Openeye Name: 3-(4-bromophenyl)-4-(2-furylmethyl)-1H-1,2,4-triazole-5-thione CAS Name: 3-(4-bromophenyl)-4-(2-furanylmethyl)-1H-1,2,4-triazole-5-thione IUPAC Name: 3-(4-bromophenyl)-4-(furan-2-ylmethyl)-1H-1,2,4-triazole-5-thione Traditional Name: 3-(4-bromophenyl)-4-(2-furfuryl)-1H-1,2,4-triazole-5-thione Formula: C13H10BrN3OS MolecularWeight: 336.207

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)CN2C(=NNC2=S)C3=CC=C(C=C3)Br

Isomeric SMILES

C1=COC(=C1)CN2C(=NNC2=S)C3=CC=C(C=C3)Br

InChI

InChI=1S/C13H10BrN3OS/c14-10-5-3-9(4-6-10)12-15-16-13(19)17(12)8-11-2-1-7-18-11/h1-7H,8H2,(H,16,19)