5-[(4-bromophenyl)methylsulfanyl]-4-phenyl-1,2,4-triazol-3-amine

Systemtic Name: 5-[(4-bromophenyl)methylsulfanyl]-4-phenyl-1,2,4-triazol-3-amine Openeye Name: 5-[(4-bromophenyl)methylsulfanyl]-4-phenyl-1,2,4-triazol-3-amine CAS Name: 5-[(4-bromophenyl)methylthio]-4-phenyl-1,2,4-triazol-3-amine IUPAC Name: 5-[(4-bromophenyl)methylsulfanyl]-4-phenyl-1,2,4-triazol-3-amine Traditional Name: [5-[(4-bromobenzyl)thio]-4-phenyl-1,2,4-triazol-3-yl]amine Formula: C15H13BrN4S MolecularWeight: 361.25952

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=NN=C2SCC3=CC=C(C=C3)Br)N

Isomeric SMILES

C1=CC=C(C=C1)N2C(=NN=C2SCC3=CC=C(C=C3)Br)N

InChI

InChI=1S/C15H13BrN4S/c16-12-8-6-11(7-9-12)10-21-15-19-18-14(17)20(15)13-4-2-1-3-5-13/h1-9H,10H2,(H2,17,18)