Vitas-M small molecule compound
ethyl 2-{[(3-ethyl-5-methyl-1,2-oxazol-4-yl)carbonyl]amino}-5,6,7,8,9,10,11,12,13,14-decahydro-4H-cyclotrideca[b]thiophene-3-carboxylate
Catalog ID
STK431261
SMILES CCOC(=O)c1c(sc2c1CCCCCCCCCCC2)NC(=O)c1c(CC)noc1C
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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 C25H36N2O4S MW 460.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H36N2O4S/c1-4-19-21(17(3)31-27-19)23(28)26-24-22(25(29)30-5-2)18-15-13-11-9-7-6-8-10-12-14-16-20(18)32-24/h4-16H2,1-3H3,(H,26,28)InChIKey
LWEKRXIYGKKMBK-UHFFFAOYSA-NSynonyms
CCC1=NOC(=C1C(=O)NC2=C(C3=C(S2)CCCCCCCCCCC3)C(=O)OCC)C
ethyl15((3ethyl5methyl12oxazole4carbonyl)amino)14thiabicyclo(1130)hexadeca1(13)15diene16carboxylate
ethyl2(((3ethyl5methyl12oxazol4yl)carbonyl)amino)567891011121314decahydro4Hcyclotrideca(b)thiophene3carboxylate
InChI=1SC25H36N2O4Sc141921(17(3)312719)23(28)262422(25(29)3052)1815131197681012141620(18)3224h416H213H3(H2628)
MFCD03074777
ZINC000008454866
ZINC08454866
ZINC8454866
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