Vitas-M small molecule compound
5-[3-(benzyloxy)phenyl]-4-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonyl)-1-{5-[(4-fluorobenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-3-hydroxy-1,5-dihydro-2H-pyrrol-2-one
Catalog ID
STK907887
SMILES Fc1ccc(cc1)CSc1nnc(s1)N1C(c2cccc(c2)OCc2ccccc2)C(=C(C1=O)O)C(=O)c1ccc2c(c1)OCCO2
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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 C35H26FN3O6S2 MW 667.74 g/mol Purity >90% as per NMR
InChI
InChI=1S/C35H26FN3O6S2/c36-25-12-9-22(10-13-25)20-46-35-38-37-34(47-35)39-30(23-7-4-8-26(17-23)45-19-21-5-2-1-3-6-21)29(32(41)33(39)42)31(40)24-11-14-27-28(18-24)44-16-15-43-27/h1-14,17-18,30,41H,15-16,19-20H2InChIKey
ZZQLHPFTIJGJIS-UHFFFAOYSA-NSynonyms
5(3(benzyloxy)phenyl)4(23dihydro14benzodioxin6ylcarbonyl)1(5((4fluorobenzyl)sulfanyl)134thiadiazol2yl)3hydroxy15dihydro2Hpyrrol2one
5(3(benzyloxy)phenyl)4(23dihydrobenzo(b)(14)dioxine6carbonyl)1(5((4fluorobenzyl)thio)134thiadiazol2yl)3hydroxy1Hpyrrol2(5H)one
MFCD04534342
ZINC000097968180
ZINC000097968181
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