Vitas-M small molecule compound
(3a'S,6a'R)-5'-cycloheptyl-6,7-dimethyl-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
STL533178
SMILES CSCCC1NC2([C@H]3[C@@H]1C(=O)N(C3=O)C1CCCCCC1)C(=O)Nc1c2ccc(c1C)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 C25H33N3O3S MW 455.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H33N3O3S/c1-14-10-11-17-21(15(14)2)26-24(31)25(17)20-19(18(27-25)12-13-32-3)22(29)28(23(20)30)16-8-6-4-5-7-9-16/h10-11,16,18-20,27H,4-9,12-13H2,1-3H3,(H,26,31)/t18?,19-,20+,25?/m1/s1InChIKey
GZXPTFUWONXIAV-PXRUUTNOSA-NSynonyms
956980-16-8(3~(a)~(R)6~(a)~(S))5cycloheptyl67dimethyl1(2methylsulfanylethyl)spiro(123~(a)6~(a)tetrahydropyrrolo(34c)pyrrole331~(H)indole)246trione
(3aS6aR)5cycloheptyl67dimethyl3(2(methylsulfanyl)ethyl)3a6adihydro2Hspiro(indole31pyrrolo(34c)pyrrole)246(1H3H5H)trione
(3aS6aR)5cycloheptyl67dimethyl3(2(methylthio)ethyl)33adihydro2Hspiro(indoline31pyrrolo(34c)pyrrole)246(5H6aH)trione
16403210
956980168
CSCCC1NC2((C@H)3(C@@H)1C(=O)N(C3=O)C1CCCCCC1)C(=O)Nc1c2ccc(c1C)C
InChI=1SC25H33N3O3Sc11410111721(15(14)2)2624(31)25(17)2019(18(2725)1213323)22(29)28(23(20)30)1686457916h101116182027H491213H213H3(H2631)t18?1920+25?m1s1
MFCD06495317
ZINC000015958621
ZINC000015958624
Check stock
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Check stock on Vitas-MAvailable files
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