Vitas-M small molecule compound

(3a'S,6a'R)-5'-tert-butyl-7-methyl-3'-(propan-2-yl)-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
STK595382
SMILES CC(C1NC2([C@H]3[C@@H]1C(=O)N(C3=O)C(C)(C)C)C(=O)Nc1c2cccc1C)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 C21H27N3O3 MW 369.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H27N3O3/c1-10(2)15-13-14(18(26)24(17(13)25)20(4,5)6)21(23-15)12-9-7-8-11(3)16(12)22-19(21)27/h7-10,13-15,23H,1-6H3,(H,22,27)/t13-,14-,15?,21?/m0/s1
InChIKey
DMKXXMBABNHHDX-QGACTYJJSA-N
Synonyms
1212493-75-8
(3aR6aS)5tertbutyl7methyl1propan2ylspiro(123a6atetrahydropyrrolo(34c)pyrrole331Hindole)246trione
(3aS6aR)5(tertbutyl)3isopropyl7methyl33adihydro2Hspiro(indoline31pyrrolo(34c)pyrrole)246(5H6aH)trione
(3aS6aR)5tertbutyl7methyl3(propan2yl)3a6adihydro2Hspiro(indole31pyrrolo(34c)pyrrole)246(1H3H5H)trione
1212493758
CC(C1NC2((C@H)3(C@@H)1C(=O)N(C3=O)C(C)(C)C)C(=O)Nc1c2cccc1C)C
CC1=CC=CC2=C1NC(=O)C23C4C(C(N3)C(C)C)C(=O)N(C4=O)C(C)(C)C
InChI=1SC21H27N3O3c110(2)151314(18(26)24(17(13)25)20(45)6)21(2315)1297811(3)16(12)2219(21)27h710131523H16H3(H2227)t131415?21?m0s1
MFCD06787853
ZINC000016022210
ZINC000016022213

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Available files

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