Vitas-M small molecule compound
(3a'S,6a'R)-5-chloro-3'-(1-hydroxyethyl)-5'-(3-methoxypropyl)-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
STK621613
SMILES COCCCN1C(=O)[C@H]2[C@@H](C1=O)C1(NC2C(O)C)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 C19H22ClN3O5 MW 407.85 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H22ClN3O5/c1-9(24)15-13-14(17(26)23(16(13)25)6-3-7-28-2)19(22-15)11-8-10(20)4-5-12(11)21-18(19)27/h4-5,8-9,13-15,22,24H,3,6-7H2,1-2H3,(H,21,27)/t9?,13-,14-,15?,19?/m0/s1InChIKey
VXRCVFIFZKEBQI-JGRDVOMXSA-NSynonyms
1212486-99-1(3aR6aS)5chloro1(1hydroxyethyl)5(3methoxypropyl)spiro(123a6atetrahydropyrrolo(34c)pyrrole331Hindole)246trione
(3aS6aR)5chloro3(1hydroxyethyl)5(3methoxypropyl)33adihydro2Hspiro(indoline31pyrrolo(34c)pyrrole)246(5H6aH)trione
(3aS6aR)5chloro3(1hydroxyethyl)5(3methoxypropyl)3a6adihydro2Hspiro(indole31pyrrolo(34c)pyrrole)246(1H3H5H)trione
1212486991
CC(C1C2C(C(=O)N(C2=O)CCCOC)C3(N1)C4=C(C=CC(=C4)Cl)NC3=O)O
COCCCN1C(=O)(C@H)2(C@@H)(C1=O)C1(NC2C(O)C)C(=O)Nc2c1cc(Cl)cc2
InChI=1SC19H22ClN3O5c19(24)151314(17(26)23(16(13)25)637282)19(2215)11810(20)4512(11)2118(19)27h458913152224H367H212H3(H2127)t9?131415?19?m0s1
MFCD06786629
ZINC000013692654
ZINC000230000450
Check stock
See real-time availability and sample size for STK621613 on the Vitas-M platform.
Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.