Vitas-M small molecule compound
3-{[4-(4-butylphenyl)-5-methyl-1,3-thiazol-2-yl]carbamoyl}-7-oxabicyclo[2.2.1]heptane-2-carboxylic acid
Catalog ID
STK449337
SMILES CCCCc1ccc(cc1)c1nc(sc1C)NC(=O)C1C2CCC(C1C(=O)O)O2
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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 C22H26N2O4S MW 414.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H26N2O4S/c1-3-4-5-13-6-8-14(9-7-13)19-12(2)29-22(23-19)24-20(25)17-15-10-11-16(28-15)18(17)21(26)27/h6-9,15-18H,3-5,10-11H2,1-2H3,(H,26,27)(H,23,24,25)InChIKey
UQAZYJMSFKAQAG-UHFFFAOYSA-NSynonyms
2((4(4BUTYLPHENYL)5METHYL13THIAZOL2YL)CARBAMOYL)7OXABICYCLO(221)HEPTANE3CARBOXYLICACID
3(((4(4BUTYLPHENYL)5METHYL13THIAZOL2YL)AMINO)CARBONYL)7OXABICYCLO(221)HEPTANE2CARBOXYLICACID
3((4(4butylphenyl)5methyl13thiazol2yl)carbamoyl)7oxabicyclo(221)heptane2carboxylicacid
3(N(4(4BUTYLPHENYL)5METHYL13THIAZOL2YL)CARBAMOYL)7OXABICYCLO(221)HEPTANE2CARBOXYLICACID
CCCCC1=CC=C(C=C1)C2=C(SC(=N2)NC(=O)C3C4CCC(C3C(=O)O)O4)C
InChI=1SC22H26N2O4Sc1345136814(9713)1912(2)2922(2319)2420(25)1715101116(2815)18(17)21(26)27h691518H351011H212H3(H2627)(H232425)
MFCD03075352
ZINC000169367259
ZINC000239229077
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