Vitas-M small molecule compound

(3R,3'S,3a'S,6a'R)-5'-(4-methoxybenzyl)-3'-[2-(methylsulfanyl)ethyl]-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
STL530254
SMILES CSCC[C@@H]1N[C@@]2([C@H]3[C@@H]1C(=O)N(C3=O)Cc1ccc(cc1)OC)C(=O)Nc1c2cccc1

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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 C24H25N3O4S MW 451.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H25N3O4S/c1-31-15-9-7-14(8-10-15)13-27-21(28)19-18(11-12-32-2)26-24(20(19)22(27)29)16-5-3-4-6-17(16)25-23(24)30/h3-10,18-20,26H,11-13H2,1-2H3,(H,25,30)/t18-,19+,20-,24-/m0/s1
InChIKey
LMEDERUBZMRBBY-VKDGWMQASA-N
Synonyms
956992-31-7
(1~(S)3~(R)3~(a)~(R)6~(a)~(S))5((4methoxyphenyl)methyl)1(2methylsulfanylethyl)spiro(123~(a)6~(a)tetrahydropyrrolo(34c)pyrrole331~(H)indole)246trione
(1R3S3aS6aR)5(4methoxybenzyl)3(2(methylthio)ethyl)33adihydro2Hspiro(indoline31pyrrolo(34c)pyrrole)246(5H6aH)trione
(3R3S3aS6aR)5(4methoxybenzyl)3(2(methylsulfanyl)ethyl)3a6adihydro2Hspiro(indole31pyrrolo(34c)pyrrole)246(1H3H5H)trione
16402515
956992317
CSCC(C@@H)1N(C@@)2((C@H)3(C@@H)1C(=O)N(C3=O)Cc1ccc(cc1)OC)C(=O)Nc1c2cccc1
InChI=1SC24H25N3O4Sc131159714(81015)132721(28)1918(1112322)2624(20(19)22(27)29)16534617(16)2523(24)30h310182026H1113H212H3(H2530)t1819+2024m0s1
ZINC000015957495
ZINC15957495

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Available files

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