3-(2-bromophenyl)-5-propylsulfanyl-1,2,4-triazol-4-amine

Systemtic Name: 3-(2-bromophenyl)-5-propylsulfanyl-1,2,4-triazol-4-amine Openeye Name: 3-(2-bromophenyl)-5-propylsulfanyl-1,2,4-triazol-4-amine CAS Name: 3-(2-bromophenyl)-5-(propylthio)-1,2,4-triazol-4-amine IUPAC Name: 3-(2-bromophenyl)-5-propylsulfanyl-1,2,4-triazol-4-amine Traditional Name: [3-(2-bromophenyl)-5-(propylthio)-1,2,4-triazol-4-yl]amine Formula: C11H13BrN4S MolecularWeight: 313.21672

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=NN=C(N1N)C2=CC=CC=C2Br

Isomeric SMILES

CCCSC1=NN=C(N1N)C2=CC=CC=C2Br

InChI

InChI=1S/C11H13BrN4S/c1-2-7-17-11-15-14-10(16(11)13)8-5-3-4-6-9(8)12/h3-6H,2,7,13H2,1H3