Vitas-M small molecule compound

7-chloro-2'-(2-methoxy-5-nitrophenyl)-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
STK570311
SMILES COc1ccc(cc1N1C(=O)C2C(C1=O)C1(N3C2CCC3)C(=O)Nc2c1cc(C)cc2Cl)[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 C24H21ClN4O6 MW 496.91 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H21ClN4O6/c1-11-8-13-20(14(25)9-11)26-23(32)24(13)19-18(15-4-3-7-27(15)24)21(30)28(22(19)31)16-10-12(29(33)34)5-6-17(16)35-2/h5-6,8-10,15,18-19H,3-4,7H2,1-2H3,(H,26,32)
InChIKey
USCULKINFPUYRF-UHFFFAOYSA-N
Synonyms

(3S3aR8aS8bS)7chloro2(2methoxy5nitrophenyl)5methyl6788atetrahydro1Hspiro(indoline34pyrrolo(34a)pyrrolizine)123(2H3aH8bH)trione
7chloro2(2methoxy5nitrophenyl)5methyl3a6788a8bhexahydro1Hspiro(indole34pyrrolo(34a)pyrrolizine)123(1H2H)trione
7chloro2(2methoxy5nitrophenyl)5methylspiro(1Hindole343a6788a8bhexahydropyrrolo(34a)pyrrolizine)123trione
CC1=CC(=C2C(=C1)C3(C4C(C5N3CCC5)C(=O)N(C4=O)C6=C(C=CC(=C6)(N+)(=O)(O))OC)C(=O)N2)Cl
COc1ccc(cc1N1C(=O)(C@H)2(C@@H)(C1=O)(C@@)1(N3(C@H)2CCC3)C(=O)Nc2c1cc(C)cc2Cl)(N+)(=O)(O)
COc1ccc(cc1N1C(=O)C2C(C1=O)C1(N3C2CCC3)C(=O)Nc2c1cc(C)cc2Cl)(N+)(=O)(O)
InChI=1SC24H21ClN4O6c11181320(14(25)911)2623(32)24(13)1918(1543727(15)24)21(30)28(22(19)31)161012(29(33)34)5617(16)352h56810151819H347H212H3(H2632)
MFCD07205481
ZINC000002350645
ZINC000245328262

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Available files

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