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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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