Vitas-M small molecule compound

(3R,3'S,3a'S,6a'R)-5'-(3-chloro-2-methylphenyl)-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
STK575829
SMILES CSCC[C@@H]1N[C@@]2([C@H]3[C@@H]1C(=O)N(C3=O)c1cccc(c1C)Cl)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 C23H22ClN3O3S MW 455.96 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22ClN3O3S/c1-12-14(24)7-5-9-17(12)27-20(28)18-16(10-11-31-2)26-23(19(18)21(27)29)13-6-3-4-8-15(13)25-22(23)30/h3-9,16,18-19,26H,10-11H2,1-2H3,(H,25,30)/t16-,18+,19-,23-/m0/s1
InChIKey
SAOCOIPAZPHALZ-FAODYONGSA-N
Synonyms
1014044-84-8
(1R3S3aS6aR)5(3chloro2methylphenyl)3(2(methylthio)ethyl)33adihydro2Hspiro(indoline31pyrrolo(34c)pyrrole)246(5H6aH)trione
(1S3R3aR6aS)5(3chloro2methylphenyl)1(2methylsulfanylethyl)spiro(123a6atetrahydropyrrolo(34c)pyrrole331Hindole)246trione
(3R3S3aS6aR)5(3chloro2methylphenyl)3(2(methylsulfanyl)ethyl)3a6adihydro2Hspiro(indole31pyrrolo(34c)pyrrole)246(1H3H5H)trione
1014044848
CC1=C(C=CC=C1Cl)N2C(=O)C3C(NC4(C3C2=O)C5=CC=CC=C5NC4=O)CCSC
CSCC(C@@H)1N(C@@)2((C@H)3(C@@H)1C(=O)N(C3=O)c1cccc(c1C)Cl)C(=O)Nc1c2cccc1
InChI=1SC23H22ClN3O3Sc11214(24)75917(12)2720(28)1816(1011312)2623(19(18)21(27)29)13634815(13)2522(23)30h3916181926H1011H212H3(H2530)t1618+1923m0s1
MFCD18245537
ZINC000016013103
ZINC16013103

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Available files

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