Vitas-M small molecule compound
ethyl 2-{[(4,7,7-trimethyl-2,3-dioxobicyclo[2.2.1]hept-1-yl)carbonyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STL147272
SMILES CCOC(=O)c1c(sc2c1CCCC2)NC(=O)C12CCC(C2(C)C)(C(=O)C1=O)C
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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 C22H27NO5S MW 417.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H27NO5S/c1-5-28-18(26)14-12-8-6-7-9-13(12)29-17(14)23-19(27)22-11-10-21(4,20(22,2)3)15(24)16(22)25/h5-11H2,1-4H3,(H,23,27)InChIKey
HBRHOWIYIMLVAF-UHFFFAOYSA-NSynonyms
1212475-20-11212475201
CCOC(=O)C1=C(SC2=C1CCCC2)NC(=O)C34CCC(C3(C)C)(C(=O)C4=O)C
ethyl2(((477trimethyl23dioxobicyclo(221)hept1yl)carbonyl)amino)4567tetrahydro1benzothiophene3carboxylate
ethyl2((177trimethyl23dioxobicyclo(221)heptane4carbonyl)amino)4567tetrahydro1benzothiophene3carboxylate
ethyl2((1R4R)477trimethyl23dioxobicyclo(221)heptane1carboxamido)4567tetrahydrobenzo(b)thiophene3carboxylate
InChI=1SC22H27NO5Sc152818(26)1412867913(12)2917(14)2319(27)22111021(420(222)3)15(24)16(22)25h511H214H3(H2327)
MFCD03469436
ZINC000001836015
Check stock
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