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

Systemtic Name: 3-[(3-bromophenyl)methylsulfanyl]-5-thiophen-2-yl-1,2,4-triazol-4-amine Openeye Name: 3-[(3-bromophenyl)methylsulfanyl]-5-(2-thienyl)-1,2,4-triazol-4-amine CAS Name: 3-[(3-bromophenyl)methylthio]-5-thiophen-2-yl-1,2,4-triazol-4-amine IUPAC Name: 3-[(3-bromophenyl)methylsulfanyl]-5-thiophen-2-yl-1,2,4-triazol-4-amine Traditional Name: [3-[(3-bromobenzyl)thio]-5-(2-thienyl)-1,2,4-triazol-4-yl]amine Formula: C13H11BrN4S2 MolecularWeight: 367.28724

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Br)CSC2=NN=C(N2N)C3=CC=CS3

Isomeric SMILES

C1=CC(=CC(=C1)Br)CSC2=NN=C(N2N)C3=CC=CS3

InChI

InChI=1S/C13H11BrN4S2/c14-10-4-1-3-9(7-10)8-20-13-17-16-12(18(13)15)11-5-2-6-19-11/h1-7H,8,15H2