Vitas-M small molecule compound

(3S,3a'R,8a'S,8b'S)-7-chloro-2'-(2,6-dimethylphenyl)-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
STK582772
SMILES Cc1cc(Cl)c2c(c1)[C@@]1(C(=O)N2)N2CCC[C@H]2[C@@H]2[C@H]1C(=O)N(C2=O)c1c(C)cccc1C

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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 C25H24ClN3O3 MW 449.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H24ClN3O3/c1-12-10-15-20(16(26)11-12)27-24(32)25(15)19-18(17-8-5-9-28(17)25)22(30)29(23(19)31)21-13(2)6-4-7-14(21)3/h4,6-7,10-11,17-19H,5,8-9H2,1-3H3,(H,27,32)/t17-,18+,19-,25+/m0/s1
InChIKey
PCWOXOBCPQLRCR-WKGYELDXSA-N
Synonyms
1013886-07-1
(3S3aR8aS8bS)7chloro2(26dimethylphenyl)5methyl3a6788a8bhexahydro1Hspiro(indole34pyrrolo(34a)pyrrolizine)123(1H2H)trione
(3S3aR8aS8bS)7chloro2(26dimethylphenyl)5methyl6788atetrahydro1Hspiro(indoline34pyrrolo(34a)pyrrolizine)123(2H3aH8bH)trione
(3S3aR8aS8bS)7chloro2(26dimethylphenyl)5methylspiro(1Hindole343a6788a8bhexahydropyrrolo(34a)pyrrolizine)123trione
1013886071
CC1=C(C(=CC=C1)C)N2C(=O)C3C4CCCN4C5(C3C2=O)C6=CC(=CC(=C6NC5=O)Cl)C
Cc1cc(Cl)c2c(c1)(C@@)1(C(=O)N2)N2CCC(C@H)2(C@@H)2(C@H)1C(=O)N(C2=O)c1c(C)cccc1C
InChI=1SC25H24ClN3O3c112101520(16(26)1112)2724(32)25(15)1918(1785928(17)25)22(30)29(23(19)31)2113(2)64714(21)3h46710111719H589H213H3(H2732)t1718+1925+m0s1
MFCD18245703
ZINC000016009668
ZINC16009668

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Available files

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