Vitas-M small molecule compound
(3S,3a'R,8a'S,8b'S)-7-chloro-2'-(4-methoxyphenyl)-5-methyl-3a',6',7',8',8a',8b'-hexahydro-1'H-spiro[indole-3,4'-pyrrolo[3,4-a]pyrrolizine]-1',2,3'(1H,2'H)-trione
Catalog ID
STL530014
SMILES COc1ccc(cc1)N1C(=O)[C@H]2[C@@H](C1=O)[C@@]1(N3[C@H]2CCC3)C(=O)Nc2c1cc(C)cc2Cl
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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 C24H22ClN3O4 MW 451.91 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H22ClN3O4/c1-12-10-15-20(16(25)11-12)26-23(31)24(15)19-18(17-4-3-9-27(17)24)21(29)28(22(19)30)13-5-7-14(32-2)8-6-13/h5-8,10-11,17-19H,3-4,9H2,1-2H3,(H,26,31)/t17-,18+,19-,24+/m0/s1InChIKey
XTTCLIVISRVZBY-UAKAABGRSA-NSynonyms
956936-42-8(3~(S)3~(a)~(R)8~(a)~(S)8~(b)~(S))7chloro2(4methoxyphenyl)5methylspiro(1~(H)indole343~(a)6788~(a)8~(b)hexahydropyrrolo(34a)pyrrolizine)123trione
(3S3aR8aS8bS)7chloro2(4methoxyphenyl)5methyl3a6788a8bhexahydro1Hspiro(indole34pyrrolo(34a)pyrrolizine)123(1H2H)trione
(3S3aR8aS8bS)7chloro2(4methoxyphenyl)5methyl6788atetrahydro1Hspiro(indoline34pyrrolo(34a)pyrrolizine)123(2H3aH8bH)trione
16402940
956936428
COc1ccc(cc1)N1C(=O)(C@H)2(C@@H)(C1=O)(C@@)1(N3(C@H)2CCC3)C(=O)Nc2c1cc(C)cc2Cl
InChI=1SC24H22ClN3O4c112101520(16(25)1112)2623(31)24(15)1918(1743927(17)24)21(29)28(22(19)30)135714(322)8613h5810111719H349H212H3(H2631)t1718+1924+m0s1
MFCD06494734
ZINC000035363856
ZINC35363856
Check stock
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Check stock on Vitas-MAvailable files
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