N-(3-phenylsulfanylpropyl)-2-(1,2,3,4-tetrazol-1-yl)benzamide

Systemtic Name: N-(3-phenylsulfanylpropyl)-2-(1,2,3,4-tetrazol-1-yl)benzamide Openeye Name: N-(3-phenylsulfanylpropyl)-2-(tetrazol-1-yl)benzamide CAS Name: N-[3-(phenylthio)propyl]-2-(1-tetrazolyl)benzamide IUPAC Name: N-(3-phenylsulfanylpropyl)-2-(tetrazol-1-yl)benzamide Traditional Name: N-[3-(phenylthio)propyl]-2-(tetrazol-1-yl)benzamide Formula: C17H17N5OS MolecularWeight: 339.41478

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SCCCNC(=O)C2=CC=CC=C2N3C=NN=N3

Isomeric SMILES

C1=CC=C(C=C1)SCCCNC(=O)C2=CC=CC=C2N3C=NN=N3

InChI

InChI=1S/C17H17N5OS/c23-17(18-11-6-12-24-14-7-2-1-3-8-14)15-9-4-5-10-16(15)22-13-19-20-21-22/h1-5,7-10,13H,6,11-12H2,(H,18,23)