Vitas-M small molecule compound

(3a'S,6a'R)-7-chloro-5'-(2-chlorobenzyl)-3'-(4-hydroxybenzyl)-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
STK587176
SMILES Oc1ccc(cc1)CC1NC2([C@H]3[C@@H]1C(=O)N(C3=O)Cc1ccccc1Cl)C(=O)Nc1c2cccc1Cl

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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 C27H21Cl2N3O4 MW 522.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H21Cl2N3O4/c28-18-6-2-1-4-15(18)13-32-24(34)21-20(12-14-8-10-16(33)11-9-14)31-27(22(21)25(32)35)17-5-3-7-19(29)23(17)30-26(27)36/h1-11,20-22,31,33H,12-13H2,(H,30,36)/t20?,21-,22+,27?/m1/s1
InChIKey
DZICIYTVAWFXMK-SIBQCDDFSA-N
Synonyms
1013980-84-1
(3aR6aS)7chloro5((2chlorophenyl)methyl)1((4hydroxyphenyl)methyl)spiro(123a6atetrahydropyrrolo(34c)pyrrole331Hindole)246trione
(3aS6aR)7chloro5(2chlorobenzyl)3(4hydroxybenzyl)33adihydro2Hspiro(indoline31pyrrolo(34c)pyrrole)246(5H6aH)trione
(3aS6aR)7chloro5(2chlorobenzyl)3(4hydroxybenzyl)3a6adihydro2Hspiro(indole31pyrrolo(34c)pyrrole)246(1H3H5H)trione
1013980841
C1=CC=C(C(=C1)CN2C(=O)C3C(NC4(C3C2=O)C5=C(C(=CC=C5)Cl)NC4=O)CC6=CC=C(C=C6)O)Cl
InChI=1SC27H21Cl2N3O4c2818621415(18)133224(34)2120(121481016(33)11914)3127(22(21)25(32)35)1753719(29)23(17)3026(27)36h11120223133H1213H2(H3036)t20?2122+27?m1s1
MFCD06610967
Oc1ccc(cc1)CC1NC2((C@H)3(C@@H)1C(=O)N(C3=O)Cc1ccccc1Cl)C(=O)Nc1c2cccc1Cl
ZINC000101308170
ZINC000101308190

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Available files

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