4-phenylsulfanyl-N-[4-(1,2,3,4-tetrazol-1-yl)phenyl]butanamide

Systemtic Name: 4-phenylsulfanyl-N-[4-(1,2,3,4-tetrazol-1-yl)phenyl]butanamide Openeye Name: 4-phenylsulfanyl-N-[4-(tetrazol-1-yl)phenyl]butanamide CAS Name: 4-(phenylthio)-N-[4-(1-tetrazolyl)phenyl]butanamide IUPAC Name: 4-phenylsulfanyl-N-[4-(tetrazol-1-yl)phenyl]butanamide Traditional Name: 4-(phenylthio)-N-[4-(tetrazol-1-yl)phenyl]butyramide Formula: C17H17N5OS MolecularWeight: 339.41478

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SCCCC(=O)NC2=CC=C(C=C2)N3C=NN=N3

Isomeric SMILES

C1=CC=C(C=C1)SCCCC(=O)NC2=CC=C(C=C2)N3C=NN=N3

InChI

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