Vitas-M small molecule compound

(12aS)-2-[2-(3,4-dimethoxyphenyl)ethyl]-6-(2-ethoxyphenyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione

Catalog ID
STL538112
SMILES CCOc1ccccc1C1N2C(=O)CN(C(=O)[C@@H]2Cc2c1[nH]c1c2cccc1)CCc1ccc(c(c1)OC)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/c1-4-40-26-12-8-6-10-22(26)31-30-23(21-9-5-7-11-24(21)33-30)18-25-32(37)34(19-29(36)35(25)31)16-15-20-13-14-27(38-2)28(17-20)39-3/h5-14,17,25,31,33H,4,15-16,18-19H2,1-3H3/t25-,31?/m0/s1
InChIKey
KMMAAIAPVTWAHV-ZGAORZAOSA-N
Synonyms
956998-23-5
(12aS)2(2(34dimethoxyphenyl)ethyl)6(2ethoxyphenyl)23671212ahexahydropyrazino(1216)pyrido(34b)indole14dione
(12aS)2(34dimethoxyphenethyl)6(2ethoxyphenyl)231212atetrahydropyrazino(1216)pyrido(34b)indole14(6H7H)dione
(8~(S))6(2(34dimethoxyphenyl)ethyl)2(2ethoxyphenyl)3617triazatetracyclo(8700^(38)0^(1116))heptadeca1(10)111315tetraene47dione
16400403
956998235
CCOc1ccccc1C1N2C(=O)CN(C(=O)(C@@H)2Cc2c1(nH)c1c2cccc1)CCc1ccc(c(c1)OC)OC
InChI=1SC32H33N3O5c14402612861022(26)313023(219571124(21)3330)182532(37)34(1929(36)35(25)31)161520131427(382)28(1720)393h51417253133H415161819H213H3t2531?m0s1
MFCD05671354
ZINC000002109854
ZINC000002109856

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Available files

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