2-[2-[phenyl(2H-1,2,3,4-tetrazol-5-yl)-$l^{3}-sulfanyl]ethanoylamino]benzoate

Systemtic Name: 2-[2-[phenyl(2H-1,2,3,4-tetrazol-5-yl)-$l^{3}-sulfanyl]ethanoylamino]benzoate Openeye Name: 2-[[2-[phenyl(2H-tetrazol-5-yl)-$l^{3}-sulfanyl]acetyl]amino]benzoate CAS Name: 2-[[1-oxo-2-[phenyl(2H-tetrazol-5-yl)-$l^{3}-sulfanyl]ethyl]amino]benzoate IUPAC Name: 2-[[2-[phenyl(2H-tetrazol-5-yl)-$l^{3}-sulfanyl]acetyl]amino]benzoate Traditional Name: 2-[[2-[phenyl(2H-tetrazol-5-yl)-$l^{3}-sulfanyl]acetyl]amino]benzoate Formula: C16H13N5O3S- MolecularWeight: 355.37112

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)[S](CC(=O)NC2=CC=CC=C2C(=O)[O-])C3=NNN=N3

Isomeric SMILES

C1=CC=C(C=C1)[S](CC(=O)NC2=CC=CC=C2C(=O)[O-])C3=NNN=N3

InChI

InChI=1S/C16H14N5O3S/c22-14(17-13-9-5-4-8-12(13)15(23)24)10-25(16-18-20-21-19-16)11-6-2-1-3-7-11/h1-9H,10H2,(H,17,22)(H,23,24)(H,18,19,20,21)/p-1