Vitas-M small molecule compound

1-ethyl-2'-(2-methyl-5-nitrophenyl)-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
STL239136
SMILES CCN1c2ccccc2C2(C1=O)N1CCCC1C1C2C(=O)N(C1=O)c1cc(ccc1C)[N+](=O)[O-]

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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 C25H24N4O5 MW 460.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H24N4O5/c1-3-26-17-8-5-4-7-16(17)25(24(26)32)21-20(18-9-6-12-27(18)25)22(30)28(23(21)31)19-13-15(29(33)34)11-10-14(19)2/h4-5,7-8,10-11,13,18,20-21H,3,6,9,12H2,1-2H3
InChIKey
ONDUZDKAUDVKMM-UHFFFAOYSA-N
Synonyms

(3S3aR8aS8bS)1ethyl2(2methyl5nitrophenyl)6788atetrahydro1Hspiro(indoline34pyrrolo(34a)pyrrolizine)123(2H3aH8bH)trione
1ethyl2(2methyl5nitrophenyl)3a6788a8bhexahydro1Hspiro(indole34pyrrolo(34a)pyrrolizine)123(1H2H)trione
1ethyl2(2methyl5nitrophenyl)spiro(3a6788a8bhexahydropyrrolo(34a)pyrrolizine43indole)123trione
CCN1C2=CC=CC=C2C3(C1=O)C4C(C5N3CCC5)C(=O)N(C4=O)C6=C(C=CC(=C6)(N+)(=O)(O))C
CCN1c2ccccc2(C@@)2(C1=O)N1CCC(C@H)1(C@@H)1(C@H)2C(=O)N(C1=O)c1cc(ccc1C)(N+)(=O)(O)
CCN1c2ccccc2C2(C1=O)N1CCCC1C1C2C(=O)N(C1=O)c1cc(ccc1C)(N+)(=O)(O)
InChI=1SC25H24N4O5c132617854716(17)25(24(26)32)2120(18961227(18)25)22(30)28(23(21)31)191315(29(33)34)111014(19)2h4578101113182021H36912H212H3
MFCD07204952
ZINC000035855595
ZINC000248113629

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Available files

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