Vitas-M small molecule compound
5'-(2-methoxy-5-nitrophenyl)-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
STK569717
SMILES CSCCC1NC2(C3C1C(=O)N(C3=O)c1cc(ccc1OC)[N+](=O)[O-])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 C23H22N4O6S MW 482.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22N4O6S/c1-33-17-8-7-12(27(31)32)11-16(17)26-20(28)18-15(9-10-34-2)25-23(19(18)21(26)29)13-5-3-4-6-14(13)24-22(23)30/h3-8,11,15,18-19,25H,9-10H2,1-2H3,(H,24,30)InChIKey
SVAYYPFVOXXCKI-UHFFFAOYSA-NSynonyms
(1R3S3aS6aR)5(2methoxy5nitrophenyl)3(2(methylthio)ethyl)33adihydro2Hspiro(indoline31pyrrolo(34c)pyrrole)246(5H6aH)trione
5(2METHOXY5NITROPHENYL)1(2METHYLSULFANYLETHYL)SPIRO(123A6ATETRAHYDROPYRROLO(34C)PYRROLE331HINDOLE)246TRIONE
5(2methoxy5nitrophenyl)3(2(methylsulfanyl)ethyl)3a6adihydro2Hspiro(indole31pyrrolo(34c)pyrrole)246(1H3H5H)trione
COC1=C(C=C(C=C1)(N+)(=O)(O))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)c1cc(ccc1OC)(N+)(=O)(O))C(=O)Nc1c2cccc1
CSCCC1NC2(C3C1C(=O)N(C3=O)c1cc(ccc1OC)(N+)(=O)(O))C(=O)Nc1c2cccc1
InChI=1SC23H22N4O6Sc133178712(27(31)32)1116(17)2620(28)1815(910342)2523(19(18)21(26)29)13534614(13)2422(23)30h381115181925H910H212H3(H2430)
MFCD07202381
ZINC000009359475
ZINC000105796325
Check stock
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Check stock on Vitas-MAvailable files
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