N-[2-[[4-azanyl-5-(3-bromophenyl)-1,2,4-triazol-3-yl]sulfanyl]ethyl]ethanamide

Systemtic Name: N-[2-[[4-azanyl-5-(3-bromophenyl)-1,2,4-triazol-3-yl]sulfanyl]ethyl]ethanamide Openeye Name: N-[2-[[4-amino-5-(3-bromophenyl)-1,2,4-triazol-3-yl]sulfanyl]ethyl]acetamide CAS Name: N-[2-[[4-amino-5-(3-bromophenyl)-1,2,4-triazol-3-yl]thio]ethyl]acetamide IUPAC Name: N-[2-[[4-amino-5-(3-bromophenyl)-1,2,4-triazol-3-yl]sulfanyl]ethyl]acetamide Traditional Name: N-[2-[[4-amino-5-(3-bromophenyl)-1,2,4-triazol-3-yl]thio]ethyl]acetamide Formula: C12H14BrN5OS MolecularWeight: 356.24146

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCCSC1=NN=C(N1N)C2=CC(=CC=C2)Br

Isomeric SMILES

CC(=O)NCCSC1=NN=C(N1N)C2=CC(=CC=C2)Br

InChI

InChI=1S/C12H14BrN5OS/c1-8(19)15-5-6-20-12-17-16-11(18(12)14)9-3-2-4-10(13)7-9/h2-4,7H,5-6,14H2,1H3,(H,15,19)