Vitas-M small molecule compound

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

Catalog ID
STL531322
SMILES COc1ccc(cc1)C1CN2C(=O)CN(C(=O)[C@@]2(c2c1c1ccccc1[nH]2)C)Cc1ccccc1Cl

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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 C29H26ClN3O3 MW 500.00 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H26ClN3O3/c1-29-27-26(21-8-4-6-10-24(21)31-27)22(18-11-13-20(36-2)14-12-18)16-33(29)25(34)17-32(28(29)35)15-19-7-3-5-9-23(19)30/h3-14,22,31H,15-17H2,1-2H3/t22?,29-/m0/s1
InChIKey
FBXAUGXHYMAFOM-JKDDQTOVSA-N
Synonyms
956925-58-9
(12bS)2(2chlorobenzyl)7(4methoxyphenyl)12bmethyl23671212bhexahydropyrazino(1212)pyrido(34b)indole14dione
(12bS)2(2chlorobenzyl)7(4methoxyphenyl)12bmethyl2367tetrahydropyrazino(1212)pyrido(34b)indole14(12H12bH)dione
(2~(S))4((2chlorophenyl)methyl)9(4methoxyphenyl)2methyl4717triazatetracyclo(8700^(27)0^(1116))heptadeca1(10)111315tetraene36dione
16402111
956925589
COc1ccc(cc1)C1CN2C(=O)CN(C(=O)(C@@)2(c2c1c1ccccc1(nH)2)C)Cc1ccccc1Cl
InChI=1SC29H26ClN3O3c1292726(218461024(21)3127)22(18111320(362)141218)1633(29)25(34)1732(28(29)35)1519735923(19)30h3142231H1517H212H3t22?29m0s1
MFCD06492920
ZINC000012874141
ZINC000012874146

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Available files

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