Vitas-M small molecule compound
5-(4-butoxy-3-ethoxyphenyl)-1-{5-[(2,4-dichlorobenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-3-hydroxy-4-[(2-methyl-2,3-dihydro-1-benzofuran-5-yl)carbonyl]-1,5-dihydro-2H-pyrrol-2-one
Catalog ID
STK907386
SMILES CCCCOc1ccc(cc1OCC)C1N(c2nnc(s2)SCc2ccc(cc2Cl)Cl)C(=O)C(=C1C(=O)c1ccc2c(c1)CC(O2)C)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 C35H33Cl2N3O6S2 MW 726.70 g/mol Purity >90% as per NMR
InChI
InChI=1S/C35H33Cl2N3O6S2/c1-4-6-13-45-27-12-8-20(16-28(27)44-5-2)30-29(31(41)21-9-11-26-23(15-21)14-19(3)46-26)32(42)33(43)40(30)34-38-39-35(48-34)47-18-22-7-10-24(36)17-25(22)37/h7-12,15-17,19,30,42H,4-6,13-14,18H2,1-3H3InChIKey
WJOFJUSIWLHHAV-UHFFFAOYSA-NSynonyms
5(4butoxy3ethoxyphenyl)1(5((24dichlorobenzyl)sulfanyl)134thiadiazol2yl)3hydroxy4((2methyl23dihydro1benzofuran5yl)carbonyl)15dihydro2Hpyrrol2one
5(4butoxy3ethoxyphenyl)1(5((24dichlorobenzyl)thio)134thiadiazol2yl)3hydroxy4(2methyl23dihydrobenzofuran5carbonyl)1Hpyrrol2(5H)one
MFCD18065135
ZINC000097968373
ZINC000097968376
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