Vitas-M small molecule compound
(3a'S,6a'R)-5'-butyl-3'-(1-hydroxyethyl)-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
STK573229
SMILES CCCCN1C(=O)[C@H]2[C@@H](C1=O)C1(NC2C(O)C)C(=O)Nc2c1cccc2
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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 C19H23N3O4 MW 357.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H23N3O4/c1-3-4-9-22-16(24)13-14(17(22)25)19(21-15(13)10(2)23)11-7-5-6-8-12(11)20-18(19)26/h5-8,10,13-15,21,23H,3-4,9H2,1-2H3,(H,20,26)/t10?,13-,14-,15?,19?/m0/s1InChIKey
DOMSBGXMTOVLON-JMDJNRQESA-NSynonyms
1212465-03-6(3aR6aS)5butyl1(1hydroxyethyl)spiro(123a6atetrahydropyrrolo(34c)pyrrole331Hindole)246trione
(3aS6aR)5butyl3(1hydroxyethyl)33adihydro2Hspiro(indoline31pyrrolo(34c)pyrrole)246(5H6aH)trione
(3aS6aR)5butyl3(1hydroxyethyl)3a6adihydro2Hspiro(indole31pyrrolo(34c)pyrrole)246(1H3H5H)trione
1212465036
CCCCN1C(=O)(C@H)2(C@@H)(C1=O)C1(NC2C(O)C)C(=O)Nc2c1cccc2
CCCCN1C(=O)C2C(C1=O)C3(C4=CC=CC=C4NC3=O)NC2C(C)O
InChI=1SC19H23N3O4c13492216(24)1314(17(22)25)19(2115(13)10(2)23)11756812(11)2018(19)26h581013152123H349H212H3(H2026)t10?131415?19?m0s1
MFCD06790514
ZINC000013574432
ZINC000105352317
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