2-[[1-(4-bromophenyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]-N-[3-(trifluoromethyl)phenyl]ethanamide

Systemtic Name: 2-[[1-(4-bromophenyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]-N-[3-(trifluoromethyl)phenyl]ethanamide Openeye Name: 2-[1-(4-bromophenyl)tetrazol-5-yl]sulfanyl-N-[3-(trifluoromethyl)phenyl]acetamide CAS Name: 2-[[1-(4-bromophenyl)-5-tetrazolyl]thio]-N-[3-(trifluoromethyl)phenyl]acetamide IUPAC Name: 2-[1-(4-bromophenyl)tetrazol-5-yl]sulfanyl-N-[3-(trifluoromethyl)phenyl]acetamide Traditional Name: 2-[[1-(4-bromophenyl)tetrazol-5-yl]thio]-N-[3-(trifluoromethyl)phenyl]acetamide Formula: C16H11BrF3N5OS MolecularWeight: 458.25565

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC(=O)CSC2=NN=NN2C3=CC=C(C=C3)Br)C(F)(F)F

Isomeric SMILES

C1=CC(=CC(=C1)NC(=O)CSC2=NN=NN2C3=CC=C(C=C3)Br)C(F)(F)F

InChI

InChI=1S/C16H11BrF3N5OS/c17-11-4-6-13(7-5-11)25-15(22-23-24-25)27-9-14(26)21-12-3-1-2-10(8-12)16(18,19)20/h1-8H,9H2,(H,21,26)