Vitas-M small molecule compound

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

Catalog ID
STL529612
SMILES CCc1ccc(cc1)C1CN2C(=O)CN(C(=O)[C@@]2(c2c1c1ccccc1[nH]2)C)Cc1ccccc1OC

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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 C31H31N3O3 MW 493.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H31N3O3/c1-4-20-13-15-21(16-14-20)24-18-34-27(35)19-33(17-22-9-5-8-12-26(22)37-3)30(36)31(34,2)29-28(24)23-10-6-7-11-25(23)32-29/h5-16,24,32H,4,17-19H2,1-3H3/t24?,31-/m0/s1
InChIKey
SHAWBEGXQMSCAL-KEASEGHRSA-N
Synonyms
956966-20-4
(12bS)7(4ethylphenyl)2(2methoxybenzyl)12bmethyl23671212bhexahydropyrazino(1212)pyrido(34b)indole14dione
(12bS)7(4ethylphenyl)2(2methoxybenzyl)12bmethyl2367tetrahydropyrazino(1212)pyrido(34b)indole14(12H12bH)dione
(2~(S))9(4ethylphenyl)4((2methoxyphenyl)methyl)2methyl4717triazatetracyclo(8700^(27)0^(1116))heptadeca1(10)111315tetraene36dione
16402965
956966204
CCc1ccc(cc1)C1CN2C(=O)CN(C(=O)(C@@)2(c2c1c1ccccc1(nH)2)C)Cc1ccccc1OC
InChI=1SC31H31N3O3c1420131521(161420)24183427(35)1933(17229581226(22)373)30(36)31(342)2928(24)2310671125(23)3229h5162432H41719H213H3t24?31m0s1
MFCD06494787
ZINC000008789232
ZINC000012878730

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Available files

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