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

Systemtic Name: 3-[[1-(4-bromophenyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]-N-ethyl-propanamide Openeye Name: 3-[1-(4-bromophenyl)tetrazol-5-yl]sulfanyl-N-ethyl-propanamide CAS Name: 3-[[1-(4-bromophenyl)-5-tetrazolyl]thio]-N-ethylpropanamide IUPAC Name: 3-[1-(4-bromophenyl)tetrazol-5-yl]sulfanyl-N-ethylpropanamide Traditional Name: 3-[[1-(4-bromophenyl)tetrazol-5-yl]thio]-N-ethyl-propionamide Formula: C12H14BrN5OS MolecularWeight: 356.24146

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)CCSC1=NN=NN1C2=CC=C(C=C2)Br

Isomeric SMILES

CCNC(=O)CCSC1=NN=NN1C2=CC=C(C=C2)Br

InChI

InChI=1S/C12H14BrN5OS/c1-2-14-11(19)7-8-20-12-15-16-17-18(12)10-5-3-9(13)4-6-10/h3-6H,2,7-8H2,1H3,(H,14,19)