Vitas-M small molecule compound

(12bS)-7-(2-ethoxy-3-methoxyphenyl)-2-(4-methoxybenzyl)-12b-methyl-2,3,6,7,12,12b-hexahydropyrazino[1',2':1,2]pyrido[3,4-b]indole-1,4-dione

Catalog ID
STL529459
SMILES CCOc1c(OC)cccc1C1CN2C(=O)CN(C(=O)[C@@]2(c2c1c1ccccc1[nH]2)C)Cc1ccc(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/c1-5-40-29-22(10-8-12-26(29)39-4)24-18-35-27(36)19-34(17-20-13-15-21(38-3)16-14-20)31(37)32(35,2)30-28(24)23-9-6-7-11-25(23)33-30/h6-16,24,33H,5,17-19H2,1-4H3/t24?,32-/m0/s1
InChIKey
WUHVFMXNNPAYGP-TWAVRPEISA-N
Synonyms
956953-44-9
(12bS)7(2ethoxy3methoxyphenyl)2(4methoxybenzyl)12bmethyl23671212bhexahydropyrazino(1212)pyrido(34b)indole14dione
(12bS)7(2ethoxy3methoxyphenyl)2(4methoxybenzyl)12bmethyl2367tetrahydropyrazino(1212)pyrido(34b)indole14(12H12bH)dione
(2~(S))9(2ethoxy3methoxyphenyl)4((4methoxyphenyl)methyl)2methyl4717triazatetracyclo(8700^(27)0^(1116))heptadeca1(10)111315tetraene36dione
16402212
956953449
CCOc1c(OC)cccc1C1CN2C(=O)CN(C(=O)(C@@)2(c2c1c1ccccc1(nH)2)C)Cc1ccc(cc1)OC
InChI=1SC32H33N3O5c15402922(1081226(29)394)24183527(36)1934(1720131521(383)161420)31(37)32(352)3028(24)239671125(23)3330h6162433H51719H214H3t24?32m0s1
MFCD06493166
ZINC000070692156
ZINC000070692157

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Available files

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