Vitas-M small molecule compound
ethyl 4-({[(2'S,3R,7a'S)-2-oxo-1,1',2,2',5',6',7',7a'-octahydrospiro[indole-3,3'-pyrrolizin]-2'-yl]carbonyl}amino)benzoate
Catalog ID
STL534743
SMILES CCOC(=O)c1ccc(cc1)NC(=O)[C@H]1C[C@H]2N([C@@]31C(=O)Nc1c3cccc1)CCC2
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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 C24H25N3O4 MW 419.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H25N3O4/c1-2-31-22(29)15-9-11-16(12-10-15)25-21(28)19-14-17-6-5-13-27(17)24(19)18-7-3-4-8-20(18)26-23(24)30/h3-4,7-12,17,19H,2,5-6,13-14H2,1H3,(H,25,28)(H,26,30)/t17-,19+,24-/m0/s1InChIKey
RKQZVYFIUMOCFC-PDOGEWKWSA-NSynonyms
956435-60-27097631
956435602
CCOC(=O)c1ccc(cc1)NC(=O)(C@H)1C(C@H)2N((C@@)31C(=O)Nc1c3cccc1)CCC2
ethyl4((((2S3R7aS)2oxo11225677aoctahydrospiro(indole33pyrrolizin)2yl)carbonyl)amino)benzoate
ethyl4(((2~(S)3~(R)8~(S))2oxospiro(125678hexahydropyrrolizine331~(H)indole)2carbonyl)amino)benzoate
ethyl4((2S3R7aS)2oxo125677ahexahydrospiro(indoline33pyrrolizin)2ylcarboxamido)benzoate
InChI=1SC24H25N3O4c123122(29)1591116(121015)2521(28)191417651327(17)24(19)18734820(18)2623(24)30h347121719H2561314H21H3(H2528)(H2630)t1719+24m0s1
MFCD07637862
ZINC000057992085
ZINC57992085
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