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8-(butoxymethyl)-3-({[5-(2-chlorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)-3-methyl-2,7-dioxaspiro[4.4]nonane-1,6-dione

Catalog ID
STK721937
SMILES CCCCOCC1OC(=O)C2(C1)CC(OC2=O)(C)C(=O)CSc1nnc([nH]1)c1ccccc1Cl

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C23H26ClN3O6S MW 507.99 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H26ClN3O6S/c1-3-4-9-31-11-14-10-23(19(29)32-14)13-22(2,33-20(23)30)17(28)12-34-21-25-18(26-27-21)15-7-5-6-8-16(15)24/h5-8,14H,3-4,9-13H2,1-2H3,(H,25,26,27)
InChIKey
KPBXLCZGZGNIOY-UHFFFAOYSA-N
Synonyms
342431-29-2
2(BUTOXYMETHYL)7(2((5(2CHLOROPHENYL)1H124TRIAZOL3YL)SULFANYL)ACETYL)7METHYL38DIOXASPIRO(44)NONANE49DIONE
342431292
8(butoxymethyl)3(((5(2chlorophenyl)4H124triazol3yl)sulfanyl)acetyl)3methyl27dioxaspiro(44)nonane16dione
8(butoxymethyl)3(2((5(2chlorophenyl)1H124triazol3yl)sulfanyl)acetyl)3methyl27dioxaspiro(44)nonane16dione
8(butoxymethyl)3(2((5(2chlorophenyl)4H124triazol3yl)thio)acetyl)3methyl27dioxaspiro(44)nonane16dione
8(BUTOXYMETHYL)3(2(5(2CHLOROPHENYL)(4H124TRIAZOL3YLTHIO))ACETYL)3METHYL27DIOXASPIRO(44)NONANE16DIONE
CCCCOCC1CC2(CC(OC2=O)(C)C(=O)CSC3=NNC(=N3)C4=CC=CC=C4Cl)C(=O)O1
CCCCOCC1OC(=O)C2(C1)CC(OC2=O)(C)C(=O)CSc1nnc((nH)1)c1ccccc1Cl
InChI=1SC23H26ClN3O6Sc13493111141023(19(29)3214)1322(23320(23)30)17(28)1234212518(262721)15756816(15)24h5814H34913H212H3(H252627)
MFCD01819905
ZINC000002263280
ZINC000229851975

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Available files

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