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-propoxyphenyl)-1,5-dihydro-2H-pyrrol-2-one
Catalog ID
STK908724
SMILES CCCOc1cccc(c1)C1N(c2nnc(s2)SCc2ccc(cc2)Cl)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 C31H26ClN3O6S2 MW 636.15 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H26ClN3O6S2/c1-2-12-39-22-5-3-4-19(15-22)26-25(27(36)20-8-11-23-24(16-20)41-14-13-40-23)28(37)29(38)35(26)30-33-34-31(43-30)42-17-18-6-9-21(32)10-7-18/h3-11,15-16,26,37H,2,12-14,17H2,1H3InChIKey
QACARLVBDWEHHK-UHFFFAOYSA-NSynonyms
1(5((4chlorobenzyl)sulfanyl)134thiadiazol2yl)4(23dihydro14benzodioxin6ylcarbonyl)3hydroxy5(3propoxyphenyl)15dihydro2Hpyrrol2one
1(5((4chlorobenzyl)thio)134thiadiazol2yl)4(23dihydrobenzo(b)(14)dioxine6carbonyl)3hydroxy5(3propoxyphenyl)1Hpyrrol2(5H)one
MFCD04594870
ZINC000097968410
ZINC000097968411
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