2-[(1-tert-butyl-1,2,3,4-tetrazol-5-yl)sulfanyl]-1-(4-hydroxyphenyl)ethanone

Systemtic Name: 2-[(1-tert-butyl-1,2,3,4-tetrazol-5-yl)sulfanyl]-1-(4-hydroxyphenyl)ethanone Openeye Name: 2-(1-tert-butyltetrazol-5-yl)sulfanyl-1-(4-hydroxyphenyl)ethanone CAS Name: 2-[(1-tert-butyl-5-tetrazolyl)thio]-1-(4-hydroxyphenyl)ethanone IUPAC Name: 2-(1-tert-butyltetrazol-5-yl)sulfanyl-1-(4-hydroxyphenyl)ethanone Traditional Name: 2-[(1-tert-butyltetrazol-5-yl)thio]-1-(4-hydroxyphenyl)ethanone Formula: C13H16N4O2S MolecularWeight: 292.35674

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N1C(=NN=N1)SCC(=O)C2=CC=C(C=C2)O

Isomeric SMILES

CC(C)(C)N1C(=NN=N1)SCC(=O)C2=CC=C(C=C2)O

InChI

InChI=1S/C13H16N4O2S/c1-13(2,3)17-12(14-15-16-17)20-8-11(19)9-4-6-10(18)7-5-9/h4-7,18H,8H2,1-3H3