Vitas-M small molecule compound
5-[4-(benzyloxy)-3-ethoxyphenyl]-4-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonyl)-1-{5-[(2-fluorobenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-3-hydroxy-1,5-dihydro-2H-pyrrol-2-one
Catalog ID
STK883771
SMILES CCOc1cc(ccc1OCc1ccccc1)C1N(c2nnc(s2)SCc2ccccc2F)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 C37H30FN3O7S2 MW 711.79 g/mol Purity >90% as per NMR
InChI
InChI=1S/C37H30FN3O7S2/c1-2-45-29-18-23(12-14-28(29)48-20-22-8-4-3-5-9-22)32-31(33(42)24-13-15-27-30(19-24)47-17-16-46-27)34(43)35(44)41(32)36-39-40-37(50-36)49-21-25-10-6-7-11-26(25)38/h3-15,18-19,32,43H,2,16-17,20-21H2,1H3InChIKey
GXTGLEXZEVHBKH-UHFFFAOYSA-NSynonyms
5(4(benzyloxy)3ethoxyphenyl)4(23dihydro14benzodioxin6ylcarbonyl)1(5((2fluorobenzyl)sulfanyl)134thiadiazol2yl)3hydroxy15dihydro2Hpyrrol2one
5(4(benzyloxy)3ethoxyphenyl)4(23dihydrobenzo(b)(14)dioxine6carbonyl)1(5((2fluorobenzyl)thio)134thiadiazol2yl)3hydroxy1Hpyrrol2(5H)one
MFCD04530867
ZINC000097968220
ZINC000097968221
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