Vitas-M small molecule compound
ethyl 4-(4-{[(1S,9aR)-octahydro-2H-quinolizin-1-ylmethyl]carbamoyl}-2-oxopyrrolidin-1-yl)benzoate
Catalog ID
STL546971
SMILES CCOC(=O)c1ccc(cc1)N1CC(CC1=O)C(=O)NC[C@@H]1CCCN2[C@@H]1CCCC2
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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 C24H33N3O4 MW 427.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H33N3O4/c1-2-31-24(30)17-8-10-20(11-9-17)27-16-19(14-22(27)28)23(29)25-15-18-6-5-13-26-12-4-3-7-21(18)26/h8-11,18-19,21H,2-7,12-16H2,1H3,(H,25,29)/t18-,19?,21+/m0/s1InChIKey
QXTHXPYIMNKLNG-OWJBEEKMSA-NSynonyms
110206316
CCOC(=O)c1ccc(cc1)N1CC(CC1=O)C(=O)NC(C@@H)1CCCN2(C@@H)1CCCC2
ETHYL4(4((((1S9AR)OCTAHYDRO1HQUINOLIZIN1YL)METHYL)CARBAMOYL)2OXOPYRROLIDIN1YL)BENZOATE
ethyl4(4(((1~(S)9~(a)~(R))23467899~(a)octahydro1~(H)quinolizin1yl)methylcarbamoyl)2oxopyrrolidin1yl)benzoate
ethyl4(4(((1S9aR)octahydro2Hquinolizin1ylmethyl)carbamoyl)2oxopyrrolidin1yl)benzoate
InChI=1SC24H33N3O4c123124(30)1781020(11917)271619(1422(27)28)23(29)2515186513261243721(18)26h811181921H271216H21H3(H2529)t1819?21+m0s1
ZINC000253412406
ZINC000253412407
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