Vitas-M small molecule compound
(12aS)-6-(2-ethoxyphenyl)-2-(2-methoxyethyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Catalog ID
STL540087
SMILES COCCN1CC(=O)N2[C@H](C1=O)Cc1c(C2c2ccccc2OCC)[nH]c2c1cccc2
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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 C25H27N3O4 MW 433.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H27N3O4/c1-3-32-21-11-7-5-9-17(21)24-23-18(16-8-4-6-10-19(16)26-23)14-20-25(30)27(12-13-31-2)15-22(29)28(20)24/h4-11,20,24,26H,3,12-15H2,1-2H3/t20-,24?/m0/s1InChIKey
WIVWELDCWZJQFR-QHELBMECSA-NSynonyms
956946-10-4(12aS)6(2ethoxyphenyl)2(2methoxyethyl)231212atetrahydropyrazino(1216)pyrido(34b)indole14(6H7H)dione
(12aS)6(2ethoxyphenyl)2(2methoxyethyl)23671212ahexahydropyrazino(1216)pyrido(34b)indole14dione
(8~(S))2(2ethoxyphenyl)6(2methoxyethyl)3617triazatetracyclo(8700^(38)0^(1116))heptadeca1(10)111315tetraene47dione
16400868
956946104
COCCN1CC(=O)N2(C@H)(C1=O)Cc1c(C2c2ccccc2OCC)(nH)c2c1cccc2
InChI=1SC25H27N3O4c1332211175917(21)242318(168461019(16)2623)142025(30)27(1213312)1522(29)28(20)24h411202426H31215H212H3t2024?m0s1
MFCD05672160
ZINC000002111949
ZINC000002111951
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