Vitas-M small molecule compound
methyl 4-(1-{5-[(2-chlorobenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-4-hydroxy-3-[(2-methyl-2,3-dihydro-1-benzofuran-5-yl)carbonyl]-5-oxo-2,5-dihydro-1H-pyrrol-2-yl)benzoate
Catalog ID
STK904567
SMILES COC(=O)c1ccc(cc1)C1N(c2nnc(s2)SCc2ccccc2Cl)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 C31H24ClN3O6S2 MW 634.13 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H24ClN3O6S2/c1-16-13-21-14-19(11-12-23(21)41-16)26(36)24-25(17-7-9-18(10-8-17)29(39)40-2)35(28(38)27(24)37)30-33-34-31(43-30)42-15-20-5-3-4-6-22(20)32/h3-12,14,16,25,37H,13,15H2,1-2H3InChIKey
DQYIJPVUNOQTFJ-UHFFFAOYSA-NSynonyms
methyl4(1(5((2chlorobenzyl)sulfanyl)134thiadiazol2yl)4hydroxy3((2methyl23dihydro1benzofuran5yl)carbonyl)5oxo25dihydro1Hpyrrol2yl)benzoate
methyl4(1(5((2chlorobenzyl)thio)134thiadiazol2yl)4hydroxy3(2methyl23dihydrobenzofuran5carbonyl)5oxo25dihydro1Hpyrrol2yl)benzoate
MFCD18076114
ZINC000097969234
ZINC000097969237
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