Vitas-M small molecule compound
(3a'S,6a'R)-5'-(2-chlorobenzyl)-3'-methyl-3a',6a'-dihydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrole]-2,4',6'(1H,3'H,5'H)-trione
Catalog ID
STL531420
SMILES CC1NC2([C@H]3[C@@H]1C(=O)N(C3=O)Cc1ccccc1Cl)C(=O)Nc1c2cccc1
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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 C21H18ClN3O3 MW 395.85 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18ClN3O3/c1-11-16-17(21(24-11)13-7-3-5-9-15(13)23-20(21)28)19(27)25(18(16)26)10-12-6-2-4-8-14(12)22/h2-9,11,16-17,24H,10H2,1H3,(H,23,28)/t11?,16-,17+,21?/m1/s1InChIKey
NCFKHNPDJQXDAA-RMDCJWFYSA-NSynonyms
956925-90-9(3~(a)~(R)6~(a)~(S))5((2chlorophenyl)methyl)1methylspiro(123~(a)6~(a)tetrahydropyrrolo(34c)pyrrole331~(H)indole)246trione
(3aS6aR)5(2chlorobenzyl)3methyl33adihydro2Hspiro(indoline31pyrrolo(34c)pyrrole)246(5H6aH)trione
(3aS6aR)5(2chlorobenzyl)3methyl3a6adihydro2Hspiro(indole31pyrrolo(34c)pyrrole)246(1H3H5H)trione
16402204
956925909
CC1NC2((C@H)3(C@@H)1C(=O)N(C3=O)Cc1ccccc1Cl)C(=O)Nc1c2cccc1
InChI=1SC21H18ClN3O3c1111617(21(2411)13735915(13)2320(21)28)19(27)25(18(16)26)1012624814(12)22h2911161724H10H21H3(H2328)t11?1617+21?m1s1
MFCD06493140
ZINC000018188794
ZINC000020610698
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