Vitas-M small molecule compound

(3a'S,6a'R)-5-methyl-3'-[2-(methylsulfanyl)ethyl]-5'-(2-phenylethyl)-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
STL530816
SMILES CSCCC1NC2([C@H]3[C@@H]1C(=O)N(C3=O)CCc1ccccc1)C(=O)Nc1c2cc(C)cc1

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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 C25H27N3O3S MW 449.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H27N3O3S/c1-15-8-9-18-17(14-15)25(24(31)26-18)21-20(19(27-25)11-13-32-2)22(29)28(23(21)30)12-10-16-6-4-3-5-7-16/h3-9,14,19-21,27H,10-13H2,1-2H3,(H,26,31)/t19?,20-,21+,25?/m1/s1
InChIKey
BDYLUWBKBGWIEL-CCQQUTMYSA-N
Synonyms
957020-80-3
(3~(a)~(R)6~(a)~(S))5methyl1(2methylsulfanylethyl)5(2phenylethyl)spiro(123~(a)6~(a)tetrahydropyrrolo(34c)pyrrole331~(H)indole)246trione
(3aS6aR)5methyl3(2(methylsulfanyl)ethyl)5(2phenylethyl)3a6adihydro2Hspiro(indole31pyrrolo(34c)pyrrole)246(1H3H5H)trione
(3aS6aR)5methyl3(2(methylthio)ethyl)5phenethyl33adihydro2Hspiro(indoline31pyrrolo(34c)pyrrole)246(5H6aH)trione
16404388
957020803
CSCCC1NC2((C@H)3(C@@H)1C(=O)N(C3=O)CCc1ccccc1)C(=O)Nc1c2cc(C)cc1
InChI=1SC25H27N3O3Sc115891817(1415)25(24(31)2618)2120(19(2725)1113322)22(29)28(23(21)30)1210166435716h3914192127H1013H212H3(H2631)t19?2021+25?m1s1
MFCD06766939
ZINC000015967975
ZINC000015967979

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Available files

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