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

Systemtic Name: N-(4-bromophenyl)-2-[(1-prop-2-enyl-1,2,3,4-tetrazol-5-yl)sulfanyl]ethanamide Openeye Name: 2-(1-allyltetrazol-5-yl)sulfanyl-N-(4-bromophenyl)acetamide CAS Name: N-(4-bromophenyl)-2-[(1-prop-2-enyl-5-tetrazolyl)thio]acetamide IUPAC Name: N-(4-bromophenyl)-2-(1-prop-2-enyltetrazol-5-yl)sulfanylacetamide Traditional Name: 2-[(1-allyltetrazol-5-yl)thio]-N-(4-bromophenyl)acetamide Formula: C12H12BrN5OS MolecularWeight: 354.22558

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=NN=N1)SCC(=O)NC2=CC=C(C=C2)Br

Isomeric SMILES

C=CCN1C(=NN=N1)SCC(=O)NC2=CC=C(C=C2)Br

InChI

InChI=1S/C12H12BrN5OS/c1-2-7-18-12(15-16-17-18)20-8-11(19)14-10-5-3-9(13)4-6-10/h2-6H,1,7-8H2,(H,14,19)