4-[[1-(4-methylphenyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]but-2-yn-1-ol

Systemtic Name: 4-[[1-(4-methylphenyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]but-2-yn-1-ol Openeye Name: 4-[1-(p-tolyl)tetrazol-5-yl]sulfanylbut-2-yn-1-ol CAS Name: 4-[[1-(4-methylphenyl)-5-tetrazolyl]thio]-2-butyn-1-ol IUPAC Name: 4-[1-(4-methylphenyl)tetrazol-5-yl]sulfanylbut-2-yn-1-ol Traditional Name: 4-[[1-(p-tolyl)tetrazol-5-yl]thio]but-2-yn-1-ol Formula: C12H12N4OS MolecularWeight: 260.31488

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=NN=N2)SCC#CCO

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=NN=N2)SCC#CCO

InChI

InChI=1S/C12H12N4OS/c1-10-4-6-11(7-5-10)16-12(13-14-15-16)18-9-3-2-8-17/h4-7,17H,8-9H2,1H3