Vitas-M small molecule compound
5-(4-butoxy-3-ethoxyphenyl)-1-{5-[(2-chlorobenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-4-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonyl)-3-hydroxy-1,5-dihydro-2H-pyrrol-2-one
Catalog ID
STK883702
SMILES CCCCOc1ccc(cc1OCC)C1N(c2nnc(s2)SCc2ccccc2Cl)C(=O)C(=C1C(=O)c1ccc2c(c1)OCCO2)O
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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 C34H32ClN3O7S2 MW 694.23 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H32ClN3O7S2/c1-3-5-14-43-24-12-10-20(17-26(24)42-4-2)29-28(30(39)21-11-13-25-27(18-21)45-16-15-44-25)31(40)32(41)38(29)33-36-37-34(47-33)46-19-22-8-6-7-9-23(22)35/h6-13,17-18,29,40H,3-5,14-16,19H2,1-2H3InChIKey
AQAXVAHUTIQKJC-UHFFFAOYSA-NSynonyms
5(4butoxy3ethoxyphenyl)1(5((2chlorobenzyl)sulfanyl)134thiadiazol2yl)4(23dihydro14benzodioxin6ylcarbonyl)3hydroxy15dihydro2Hpyrrol2one
5(4butoxy3ethoxyphenyl)1(5((2chlorobenzyl)thio)134thiadiazol2yl)4(23dihydrobenzo(b)(14)dioxine6carbonyl)3hydroxy1Hpyrrol2(5H)one
MFCD06285426
ZINC000097968046
ZINC000097968047
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