Vitas-M small molecule compound
(3S,3'S,3a'S,6a'R)-3'-methyl-5'-(3-nitrophenyl)-3a',6a'-dihydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrole]-2,4',6'(1H,3'H,5'H)-trione
Catalog ID
STL528592
SMILES C[C@@H]1N[C@]2([C@H]3[C@@H]1C(=O)N(C3=O)c1cccc(c1)[N+](=O)[O-])C(=O)Nc1c2cccc1
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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 C20H16N4O5 MW 392.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H16N4O5/c1-10-15-16(20(22-10)13-7-2-3-8-14(13)21-19(20)27)18(26)23(17(15)25)11-5-4-6-12(9-11)24(28)29/h2-10,15-16,22H,1H3,(H,21,27)/t10-,15+,16-,20+/m0/s1InChIKey
ZPHWWXPGFONSCT-KXDDBMSCSA-NSynonyms
956630-34-5(1~(S)3~(S)3~(a)~(R)6~(a)~(S))1methyl5(3nitrophenyl)spiro(123~(a)6~(a)tetrahydropyrrolo(34c)pyrrole331~(H)indole)246trione
(1S3S3AR6AS)1METHYL5(3NITROPHENYL)SPIRO(123A6ATETRAHYDROPYRROLO(34C)PYRROLE331HINDOLE)246TRIONE
(1S3S3aS6aR)3methyl5(3nitrophenyl)33adihydro2Hspiro(indoline31pyrrolo(34c)pyrrole)246(5H6aH)trione
(3S3S3aS6aR)3methyl5(3nitrophenyl)3a6adihydro2Hspiro(indole31pyrrolo(34c)pyrrole)246(1H3H5H)trione
7083914
956630345
C(C@@H)1N(C@)2((C@H)3(C@@H)1C(=O)N(C3=O)c1cccc(c1)(N+)(=O)(O))C(=O)Nc1c2cccc1
InChI=1SC20H16N4O5c1101516(20(2210)13723814(13)2119(20)27)18(26)23(17(15)25)1154612(911)24(28)29h210151622H1H3(H2127)t1015+1620+m0s1
MFCD03852849
ZINC000016031474
ZINC16031474
Check stock
See real-time availability and sample size for STL528592 on the Vitas-M platform.
Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.