Vitas-M small molecule compound
4-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonyl)-3-hydroxy-1-{5-[(naphthalen-1-ylmethyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-5-(3-propoxyphenyl)-1,5-dihydro-2H-pyrrol-2-one
Catalog ID
STK908720
SMILES CCCOc1cccc(c1)C1N(c2nnc(s2)SCc2cccc3c2cccc3)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 C35H29N3O6S2 MW 651.76 g/mol Purity >90% as per NMR
InChI
InChI=1S/C35H29N3O6S2/c1-2-15-42-25-11-6-9-22(18-25)30-29(31(39)23-13-14-27-28(19-23)44-17-16-43-27)32(40)33(41)38(30)34-36-37-35(46-34)45-20-24-10-5-8-21-7-3-4-12-26(21)24/h3-14,18-19,30,40H,2,15-17,20H2,1H3InChIKey
WHKFJHXJUSXTKU-UHFFFAOYSA-NSynonyms
4(23dihydro14benzodioxin6ylcarbonyl)3hydroxy1(5((naphthalen1ylmethyl)sulfanyl)134thiadiazol2yl)5(3propoxyphenyl)15dihydro2Hpyrrol2one
4(23dihydrobenzo(b)(14)dioxine6carbonyl)3hydroxy1(5((naphthalen1ylmethyl)thio)134thiadiazol2yl)5(3propoxyphenyl)1Hpyrrol2(5H)one
MFCD04556113
ZINC000097968109
ZINC000097968110
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