Vitas-M small molecule compound

(3S,3a'R,8a'S,8b'S)-5-chloro-2'-(2,5-dimethoxyphenyl)-7-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
STL007507
SMILES COc1ccc(cc1N1C(=O)[C@H]2[C@@H](C1=O)[C@@]1(N3[C@H]2CCC3)C(=O)Nc2c1cc(Cl)cc2C)OC

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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 C25H24ClN3O5 MW 481.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H24ClN3O5/c1-12-9-13(26)10-15-21(12)27-24(32)25(15)20-19(16-5-4-8-28(16)25)22(30)29(23(20)31)17-11-14(33-2)6-7-18(17)34-3/h6-7,9-11,16,19-20H,4-5,8H2,1-3H3,(H,27,32)/t16-,19+,20-,25+/m0/s1
InChIKey
XYAASOAOHSKPSK-KHTISZTLSA-N
Synonyms
956823-27-1
(3S3aR8aS8bS)5chloro2(25dimethoxyphenyl)7methyl3a6788a8bhexahydro1Hspiro(indole34pyrrolo(34a)pyrrolizine)123(1H2H)trione
(3S3aR8aS8bS)5chloro2(25dimethoxyphenyl)7methyl6788atetrahydro1Hspiro(indoline34pyrrolo(34a)pyrrolizine)123(2H3aH8bH)trione
(3S3aR8aS8bS)5chloro2(25dimethoxyphenyl)7methylspiro(1Hindole343a6788a8bhexahydropyrrolo(34a)pyrrolizine)123trione
956823271
CC1=C2C(=CC(=C1)Cl)C3(C4C(C5N3CCC5)C(=O)N(C4=O)C6=C(C=CC(=C6)OC)OC)C(=O)N2
COc1ccc(cc1N1C(=O)(C@H)2(C@@H)(C1=O)(C@@)1(N3(C@H)2CCC3)C(=O)Nc2c1cc(Cl)cc2C)OC
InChI=1SC25H24ClN3O5c112913(26)101521(12)2724(32)25(15)2019(1654828(16)25)22(30)29(23(20)31)171114(332)6718(17)343h67911161920H458H213H3(H2732)t1619+2025+m0s1
MFCD06495174
ZINC000035363857
ZINC35363857

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Available files

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