5-[2-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanyl]ethyl]-1,2-oxazole

Systemtic Name: 5-[2-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanyl]ethyl]-1,2-oxazole Openeye Name: 5-[2-(1-phenyltetrazol-5-yl)sulfanylethyl]isoxazole CAS Name: 5-[2-[(1-phenyl-5-tetrazolyl)thio]ethyl]isoxazole IUPAC Name: 5-[2-(1-phenyltetrazol-5-yl)sulfanylethyl]-1,2-oxazole Traditional Name: 5-[2-[(1-phenyltetrazol-5-yl)thio]ethyl]isoxazole Formula: C12H11N5OS MolecularWeight: 273.31364

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=NN=N2)SCCC3=CC=NO3

Isomeric SMILES

C1=CC=C(C=C1)N2C(=NN=N2)SCCC3=CC=NO3

InChI

InChI=1S/C12H11N5OS/c1-2-4-10(5-3-1)17-12(14-15-16-17)19-9-7-11-6-8-13-18-11/h1-6,8H,7,9H2