Vitas-M small molecule compound

(3a'S,6a'R)-5'-butyl-3',6,7-trimethyl-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
STK600815
SMILES CCCCN1C(=O)[C@H]2[C@@H](C1=O)C1(NC2C)C(=O)Nc2c1ccc(c2C)C

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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 C20H25N3O3 MW 355.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H25N3O3/c1-5-6-9-23-17(24)14-12(4)22-20(15(14)18(23)25)13-8-7-10(2)11(3)16(13)21-19(20)26/h7-8,12,14-15,22H,5-6,9H2,1-4H3,(H,21,26)/t12?,14-,15+,20?/m1/s1
InChIKey
LJLIHYGJICFFQT-YCXMQWEZSA-N
Synonyms
1212433-03-8
(3aR6aS)5butyl167trimethylspiro(123a6atetrahydropyrrolo(34c)pyrrole331Hindole)246trione
(3aS6aR)5butyl367trimethyl33adihydro2Hspiro(indoline31pyrrolo(34c)pyrrole)246(5H6aH)trione
(3aS6aR)5butyl367trimethyl3a6adihydro2Hspiro(indole31pyrrolo(34c)pyrrole)246(1H3H5H)trione
1212433038
CCCCN1C(=O)(C@H)2(C@@H)(C1=O)C1(NC2C)C(=O)Nc2c1ccc(c2C)C
CCCCN1C(=O)C2C(NC3(C2C1=O)C4=C(C(=C(C=C4)C)C)NC3=O)C
InChI=1SC20H25N3O3c15692317(24)1412(4)2220(15(14)18(23)25)138710(2)11(3)16(13)2119(20)26h7812141522H569H214H3(H2126)t12?1415+20?m1s1
MFCD06790452
ZINC000033585149
ZINC000035485412

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Available files

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