Vitas-M small molecule compound
(1'S,2'R,3R,3a'S)-1'-acetyl-2'-[(4-bromophenyl)carbonyl]-7'-methoxy-1',2'-dihydro-3a'H-spiro[indole-3,3'-pyrrolo[1,2-a]quinolin]-2(1H)-one
Catalog ID
STL527181
SMILES COc1ccc2c(c1)C=C[C@@H]1N2[C@H](C(=O)C)[C@@H]([C@@]21C(=O)Nc1c2cccc1)C(=O)c1ccc(cc1)Br
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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 C29H23BrN2O4 MW 543.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H23BrN2O4/c1-16(33)26-25(27(34)17-7-10-19(30)11-8-17)29(21-5-3-4-6-22(21)31-28(29)35)24-14-9-18-15-20(36-2)12-13-23(18)32(24)26/h3-15,24-26H,1-2H3,(H,31,35)/t24-,25+,26+,29+/m0/s1InChIKey
FJARQOYNHUUOHL-YIPGRGJBSA-NSynonyms
1177632-06-2(1~(S)2~(R)3~(R)3~(a)~(S))1acetyl2(4bromobenzoyl)7methoxyspiro(1~(H)indole3323~(a)dihydro1~(H)pyrrolo(12a)quinoline)2one
(1S2R3R3aS)1acetyl2((4bromophenyl)carbonyl)7methoxy12dihydro3aHspiro(indole33pyrrolo(12a)quinolin)2(1H)one
(1S2R3R3aS)1acetyl2(4bromobenzoyl)7methoxy23adihydro1Hspiro(indoline33pyrrolo(12a)quinolin)2one
1177632062
16397866
COc1ccc2c(c1)C=C(C@@H)1N2(C@H)(C(=O)C)(C@@H)((C@@)21C(=O)Nc1c2cccc1)C(=O)c1ccc(cc1)Br
InChI=1SC29H23BrN2O4c116(33)2625(27(34)1771019(30)11817)29(21534622(21)3128(29)35)24149181520(362)121323(18)32(24)26h3152426H12H3(H3135)t2425+26+29+m0s1
MFCD03267690
ZINC000070672880
ZINC70672880
Check stock
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Check stock on Vitas-MAvailable files
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