Vitas-M small molecule compound
5-ethyl-2'-(3-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
STL059517
SMILES CCc1ccc2c(c1)C1(C(=O)N2)N2CCCC2C2C1C(=O)N(C2=O)c1cccc(c1)[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 C24H22N4O5 MW 446.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H22N4O5/c1-2-13-8-9-17-16(11-13)24(23(31)25-17)20-19(18-7-4-10-26(18)24)21(29)27(22(20)30)14-5-3-6-15(12-14)28(32)33/h3,5-6,8-9,11-12,18-20H,2,4,7,10H2,1H3,(H,25,31)InChIKey
YZHAQZXTTRKELF-UHFFFAOYSA-NSynonyms
(3S3aR8aS8bS)5ethyl2(3nitrophenyl)6788atetrahydro1Hspiro(indoline34pyrrolo(34a)pyrrolizine)123(2H3aH8bH)trione
5ethyl2(3nitrophenyl)3a6788a8bhexahydro1Hspiro(indole34pyrrolo(34a)pyrrolizine)123(1H2H)trione
5ethyl2(3nitrophenyl)spiro(1Hindole343a6788a8bhexahydropyrrolo(34a)pyrrolizine)123trione
CCC1=CC2=C(C=C1)NC(=O)C23C4C(C5N3CCC5)C(=O)N(C4=O)C6=CC(=CC=C6)(N+)(=O)(O)
CCc1ccc2c(c1)(C@@)1(C(=O)N2)N2CCC(C@H)2(C@@H)2(C@H)1C(=O)N(C2=O)c1cccc(c1)(N+)(=O)(O)
CCc1ccc2c(c1)C1(C(=O)N2)N2CCCC2C2C1C(=O)N(C2=O)c1cccc(c1)(N+)(=O)(O)
InChI=1SC24H22N4O5c1213891716(1113)24(23(31)2517)2019(18741026(18)24)21(29)27(22(20)30)1453615(1214)28(32)33h3568911121820H24710H21H3(H2531)
MFCD07207330
ZINC000016010220
ZINC000245257380
Check stock
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Check stock on Vitas-MAvailable files
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