Vitas-M small molecule compound
1-{5-[(4-chlorobenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-4-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonyl)-3-hydroxy-5-[3-(3-methylbutoxy)phenyl]-1,5-dihydro-2H-pyrrol-2-one
Catalog ID
STK908403
SMILES CC(CCOc1cccc(c1)C1N(c2nnc(s2)SCc2ccc(cc2)Cl)C(=O)C(=C1C(=O)c1ccc2c(c1)OCCO2)O)C
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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 C33H30ClN3O6S2 MW 664.20 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H30ClN3O6S2/c1-19(2)12-13-41-24-5-3-4-21(16-24)28-27(29(38)22-8-11-25-26(17-22)43-15-14-42-25)30(39)31(40)37(28)32-35-36-33(45-32)44-18-20-6-9-23(34)10-7-20/h3-11,16-17,19,28,39H,12-15,18H2,1-2H3InChIKey
NWYSLUFFCOPBBL-UHFFFAOYSA-NSynonyms
1(5((4chlorobenzyl)sulfanyl)134thiadiazol2yl)4(23dihydro14benzodioxin6ylcarbonyl)3hydroxy5(3(3methylbutoxy)phenyl)15dihydro2Hpyrrol2one
1(5((4chlorobenzyl)thio)134thiadiazol2yl)4(23dihydrobenzo(b)(14)dioxine6carbonyl)3hydroxy5(3(isopentyloxy)phenyl)1Hpyrrol2(5H)one
MFCD04530490
ZINC000097967949
ZINC000097967950
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