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

Systemtic Name: 3-[[1-(4-bromophenyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]-N-phenyl-propanamide Openeye Name: 3-[1-(4-bromophenyl)tetrazol-5-yl]sulfanyl-N-phenyl-propanamide CAS Name: 3-[[1-(4-bromophenyl)-5-tetrazolyl]thio]-N-phenylpropanamide IUPAC Name: 3-[1-(4-bromophenyl)tetrazol-5-yl]sulfanyl-N-phenylpropanamide Traditional Name: 3-[[1-(4-bromophenyl)tetrazol-5-yl]thio]-N-phenyl-propionamide Formula: C16H14BrN5OS MolecularWeight: 404.28426

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=O)CCSC2=NN=NN2C3=CC=C(C=C3)Br

Isomeric SMILES

C1=CC=C(C=C1)NC(=O)CCSC2=NN=NN2C3=CC=C(C=C3)Br

InChI

InChI=1S/C16H14BrN5OS/c17-12-6-8-14(9-7-12)22-16(19-20-21-22)24-11-10-15(23)18-13-4-2-1-3-5-13/h1-9H,10-11H2,(H,18,23)