1-(4-butylphenyl)-5-(oxan-2-ylmethylsulfanyl)-1,2,3,4-tetrazole

Systemtic Name: 1-(4-butylphenyl)-5-(oxan-2-ylmethylsulfanyl)-1,2,3,4-tetrazole Openeye Name: 1-(4-butylphenyl)-5-(tetrahydropyran-2-ylmethylsulfanyl)tetrazole CAS Name: 1-(4-butylphenyl)-5-(2-oxanylmethylthio)tetrazole IUPAC Name: 1-(4-butylphenyl)-5-(oxan-2-ylmethylsulfanyl)tetrazole Traditional Name: 1-(4-butylphenyl)-5-(tetrahydropyran-2-ylmethylthio)tetrazole Formula: C17H24N4OS MolecularWeight: 332.46366

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)N2C(=NN=N2)SCC3CCCCO3

Isomeric SMILES

CCCCC1=CC=C(C=C1)N2C(=NN=N2)SCC3CCCCO3

InChI

InChI=1S/C17H24N4OS/c1-2-3-6-14-8-10-15(11-9-14)21-17(18-19-20-21)23-13-16-7-4-5-12-22-16/h8-11,16H,2-7,12-13H2,1H3