Vitas-M small molecule compound
4-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonyl)-5-(3-ethoxyphenyl)-3-hydroxy-1-{5-[(4-methylbenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-1,5-dihydro-2H-pyrrol-2-one
Catalog ID
STK908401
SMILES CCOc1cccc(c1)C1N(c2nnc(s2)SCc2ccc(cc2)C)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 C31H27N3O6S2 MW 601.70 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H27N3O6S2/c1-3-38-22-6-4-5-20(15-22)26-25(27(35)21-11-12-23-24(16-21)40-14-13-39-23)28(36)29(37)34(26)30-32-33-31(42-30)41-17-19-9-7-18(2)8-10-19/h4-12,15-16,26,36H,3,13-14,17H2,1-2H3InChIKey
GBTDCAFMQJHMCW-UHFFFAOYSA-NSynonyms
4(23dihydro14benzodioxin6ylcarbonyl)5(3ethoxyphenyl)3hydroxy1(5((4methylbenzyl)sulfanyl)134thiadiazol2yl)15dihydro2Hpyrrol2one
4(23dihydrobenzo(b)(14)dioxine6carbonyl)5(3ethoxyphenyl)3hydroxy1(5((4methylbenzyl)thio)134thiadiazol2yl)1Hpyrrol2(5H)one
MFCD04493258
ZINC000097968031
ZINC000097968032
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