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

Systemtic Name: 3-[(2-bromophenyl)methylsulfanyl]-5-cyclopropyl-1,2,4-triazol-4-amine Openeye Name: 3-[(2-bromophenyl)methylsulfanyl]-5-cyclopropyl-1,2,4-triazol-4-amine CAS Name: 3-[(2-bromophenyl)methylthio]-5-cyclopropyl-1,2,4-triazol-4-amine IUPAC Name: 3-[(2-bromophenyl)methylsulfanyl]-5-cyclopropyl-1,2,4-triazol-4-amine Traditional Name: [3-[(2-bromobenzyl)thio]-5-cyclopropyl-1,2,4-triazol-4-yl]amine Formula: C12H13BrN4S MolecularWeight: 325.22742

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=NN=C(N2N)SCC3=CC=CC=C3Br

Isomeric SMILES

C1CC1C2=NN=C(N2N)SCC3=CC=CC=C3Br

InChI

InChI=1S/C12H13BrN4S/c13-10-4-2-1-3-9(10)7-18-12-16-15-11(17(12)14)8-5-6-8/h1-4,8H,5-7,14H2