2-[[1-(4-hydroxyphenyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]cyclohexan-1-one

Systemtic Name: 2-[[1-(4-hydroxyphenyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]cyclohexan-1-one Openeye Name: 2-[1-(4-hydroxyphenyl)tetrazol-5-yl]sulfanylcyclohexanone CAS Name: 2-[[1-(4-hydroxyphenyl)-5-tetrazolyl]thio]-1-cyclohexanone IUPAC Name: 2-[1-(4-hydroxyphenyl)tetrazol-5-yl]sulfanylcyclohexan-1-one Traditional Name: 2-[[1-(4-hydroxyphenyl)tetrazol-5-yl]thio]cyclohexanone Formula: C13H14N4O2S MolecularWeight: 290.34086

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=O)C(C1)SC2=NN=NN2C3=CC=C(C=C3)O

Isomeric SMILES

C1CCC(=O)C(C1)SC2=NN=NN2C3=CC=C(C=C3)O

InChI

InChI=1S/C13H14N4O2S/c18-10-7-5-9(6-8-10)17-13(14-15-16-17)20-12-4-2-1-3-11(12)19/h5-8,12,18H,1-4H2