2-(3-hexylsulfanyl-1,2,4-triazol-1-yl)-1-(2-hydroxyphenyl)ethanone

Systemtic Name: 2-(3-hexylsulfanyl-1,2,4-triazol-1-yl)-1-(2-hydroxyphenyl)ethanone Openeye Name: 2-(3-hexylsulfanyl-1,2,4-triazol-1-yl)-1-(2-hydroxyphenyl)ethanone CAS Name: 2-[3-(hexylthio)-1,2,4-triazol-1-yl]-1-(2-hydroxyphenyl)ethanone IUPAC Name: 2-(3-hexylsulfanyl-1,2,4-triazol-1-yl)-1-(2-hydroxyphenyl)ethanone Traditional Name: 2-[3-(hexylthio)-1,2,4-triazol-1-yl]-1-(2-hydroxyphenyl)ethanone Formula: C16H21N3O2S MolecularWeight: 319.42184

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCSC1=NN(C=N1)CC(=O)C2=CC=CC=C2O

Isomeric SMILES

CCCCCCSC1=NN(C=N1)CC(=O)C2=CC=CC=C2O

InChI

InChI=1S/C16H21N3O2S/c1-2-3-4-7-10-22-16-17-12-19(18-16)11-15(21)13-8-5-6-9-14(13)20/h5-6,8-9,12,20H,2-4,7,10-11H2,1H3