Vitas-M small molecule compound
(12aS)-6-(4-ethoxy-3-methoxyphenyl)-2-[2-(4-methoxyphenyl)ethyl]-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Catalog ID
STL537598
SMILES CCOc1ccc(cc1OC)C1N2C(=O)CN(C(=O)[C@@H]2Cc2c1[nH]c1c2cccc1)CCc1ccc(cc1)OC
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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 C32H33N3O5 MW 539.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H33N3O5/c1-4-40-27-14-11-21(17-28(27)39-3)31-30-24(23-7-5-6-8-25(23)33-30)18-26-32(37)34(19-29(36)35(26)31)16-15-20-9-12-22(38-2)13-10-20/h5-14,17,26,31,33H,4,15-16,18-19H2,1-3H3/t26-,31?/m0/s1InChIKey
UDCMYPQGYYHHMF-PAMMARIWSA-NSynonyms
956914-37-7(12aS)6(4ethoxy3methoxyphenyl)2(2(4methoxyphenyl)ethyl)23671212ahexahydropyrazino(1216)pyrido(34b)indole14dione
(12aS)6(4ethoxy3methoxyphenyl)2(4methoxyphenethyl)231212atetrahydropyrazino(1216)pyrido(34b)indole14(6H7H)dione
(8~(S))2(4ethoxy3methoxyphenyl)6(2(4methoxyphenyl)ethyl)3617triazatetracyclo(8700^(38)0^(1116))heptadeca1(10)111315tetraene47dione
16401761
956914377
CCOc1ccc(cc1OC)C1N2C(=O)CN(C(=O)(C@@H)2Cc2c1(nH)c1c2cccc1)CCc1ccc(cc1)OC
InChI=1SC32H33N3O5c144027141121(1728(27)393)313024(23756825(23)3330)182632(37)34(1929(36)35(26)31)16152091222(382)131020h51417263133H415161819H213H3t2631?m0s1
MFCD05676392
ZINC000002123213
ZINC000002123214
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.