Vitas-M small molecule compound

(3a'S,6a'R)-3'-benzyl-5'-butyl-5-chloro-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
STK581913
SMILES CCCCN1C(=O)[C@H]2[C@@H](C1=O)C1(NC2Cc2ccccc2)C(=O)Nc2c1cc(Cl)cc2

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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 C24H24ClN3O3 MW 437.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H24ClN3O3/c1-2-3-11-28-21(29)19-18(12-14-7-5-4-6-8-14)27-24(20(19)22(28)30)16-13-15(25)9-10-17(16)26-23(24)31/h4-10,13,18-20,27H,2-3,11-12H2,1H3,(H,26,31)/t18?,19-,20+,24?/m1/s1
InChIKey
ZCKMMPBAGUWCLE-ZUKXXSLGSA-N
Synonyms
1014022-90-2
(3aR6aS)1benzyl5butyl5chlorospiro(123a6atetrahydropyrrolo(34c)pyrrole331Hindole)246trione
(3aS6aR)3benzyl5butyl5chloro33adihydro2Hspiro(indoline31pyrrolo(34c)pyrrole)246(5H6aH)trione
(3aS6aR)3benzyl5butyl5chloro3a6adihydro2Hspiro(indole31pyrrolo(34c)pyrrole)246(1H3H5H)trione
1014022902
CCCCN1C(=O)(C@H)2(C@@H)(C1=O)C1(NC2Cc2ccccc2)C(=O)Nc2c1cc(Cl)cc2
CCCCN1C(=O)C2C(NC3(C2C1=O)C4=C(C=CC(=C4)Cl)NC3=O)CC5=CC=CC=C5
InChI=1SC24H24ClN3O3c123112821(29)1918(12147546814)2724(20(19)22(28)30)161315(25)91017(16)2623(24)31h41013182027H231112H21H3(H2631)t18?1920+24?m1s1
MFCD06787223
ZINC000016022165
ZINC000020549020

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Available files

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