Vitas-M small molecule compound

(12bS)-7-(3-ethoxy-4-propoxyphenyl)-12b-methyl-2-[3-(morpholin-4-yl)propyl]-2,3,6,7,12,12b-hexahydropyrazino[1',2':1,2]pyrido[3,4-b]indole-1,4-dione

Catalog ID
STL528661
SMILES CCCOc1ccc(cc1OCC)C1CN2C(=O)CN(C(=O)[C@@]2(c2c1c1ccccc1[nH]2)C)CCCN1CCOCC1

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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 C33H42N4O5 MW 574.72 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H42N4O5/c1-4-17-42-27-12-11-23(20-28(27)41-5-2)25-21-37-29(38)22-36(14-8-13-35-15-18-40-19-16-35)32(39)33(37,3)31-30(25)24-9-6-7-10-26(24)34-31/h6-7,9-12,20,25,34H,4-5,8,13-19,21-22H2,1-3H3/t25?,33-/m0/s1
InChIKey
GMKKXPVXUKEOFA-ZEWJHAJUSA-N
Synonyms
956818-72-7
(12bS)7(3ethoxy4propoxyphenyl)12bmethyl2(3(morpholin4yl)propyl)23671212bhexahydropyrazino(1212)pyrido(34b)indole14dione
(12bS)7(3ethoxy4propoxyphenyl)12bmethyl2(3morpholinopropyl)2367tetrahydropyrazino(1212)pyrido(34b)indole14(12H12bH)dione
(2~(S))9(3ethoxy4propoxyphenyl)2methyl4(3morpholin4ylpropyl)4717triazatetracyclo(8700^(27)0^(1116))heptadeca1(10)111315tetraene36dione
16404026
956818727
CCCOc1ccc(cc1OCC)C1CN2C(=O)CN(C(=O)(C@@)2(c2c1c1ccccc1(nH)2)C)CCCN1CCOCC1
InChI=1SC33H42N4O5c14174227121123(2028(27)4152)25213729(38)2236(1481335151840191635)32(39)33(373)3130(25)249671026(24)3431h67912202534H45813192122H213H3t25?33m0s1
MFCD06765924
ZINC000070699818
ZINC000070699820

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Available files

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