Vitas-M small molecule compound
4-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonyl)-1-{5-[(4-fluorobenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-3-hydroxy-5-[3-(pentyloxy)phenyl]-1,5-dihydro-2H-pyrrol-2-one
Catalog ID
STK908313
SMILES CCCCCOc1cccc(c1)C1N(c2nnc(s2)SCc2ccc(cc2)F)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 C33H30FN3O6S2 MW 647.75 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H30FN3O6S2/c1-2-3-4-14-41-24-7-5-6-21(17-24)28-27(29(38)22-10-13-25-26(18-22)43-16-15-42-25)30(39)31(40)37(28)32-35-36-33(45-32)44-19-20-8-11-23(34)12-9-20/h5-13,17-18,28,39H,2-4,14-16,19H2,1H3InChIKey
ZZCKGSFVKCACHG-UHFFFAOYSA-NSynonyms
4(23dihydro14benzodioxin6ylcarbonyl)1(5((4fluorobenzyl)sulfanyl)134thiadiazol2yl)3hydroxy5(3(pentyloxy)phenyl)15dihydro2Hpyrrol2one
4(23dihydrobenzo(b)(14)dioxine6carbonyl)1(5((4fluorobenzyl)thio)134thiadiazol2yl)3hydroxy5(3(pentyloxy)phenyl)1Hpyrrol2(5H)one
MFCD04597874
ZINC000097968154
ZINC000097968155
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