cyclohexyl 2-[[4-methyl-5-(naphthalen-1-yloxymethyl)-1,2,4-triazol-3-yl]sulfanyl]ethanoate

Systemtic Name: cyclohexyl 2-[[4-methyl-5-(naphthalen-1-yloxymethyl)-1,2,4-triazol-3-yl]sulfanyl]ethanoate Openeye Name: cyclohexyl 2-[[4-methyl-5-(1-naphthyloxymethyl)-1,2,4-triazol-3-yl]sulfanyl]acetate CAS Name: 2-[[4-methyl-5-(1-naphthalenyloxymethyl)-1,2,4-triazol-3-yl]thio]acetic acid cyclohexyl ester IUPAC Name: cyclohexyl 2-[[4-methyl-5-(naphthalen-1-yloxymethyl)-1,2,4-triazol-3-yl]sulfanyl]acetate Traditional Name: 2-[[4-methyl-5-(1-naphthoxymethyl)-1,2,4-triazol-3-yl]thio]acetic acid cyclohexyl ester Formula: C22H25N3O3S MolecularWeight: 411.5172

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCC(=O)OC2CCCCC2)COC3=CC=CC4=CC=CC=C43

Isomeric SMILES

CN1C(=NN=C1SCC(=O)OC2CCCCC2)COC3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C22H25N3O3S/c1-25-20(14-27-19-13-7-9-16-8-5-6-12-18(16)19)23-24-22(25)29-15-21(26)28-17-10-3-2-4-11-17/h5-9,12-13,17H,2-4,10-11,14-15H2,1H3