Vitas-M small molecule compound

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

Catalog ID
STL529371
SMILES CCCOc1ccc(cc1OCC)C1CN2C(=O)CN(C(=O)[C@@]2(c2c1c1ccccc1[nH]2)C)Cc1cccc(c1)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 C34H37N3O5 MW 567.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H37N3O5/c1-5-16-42-28-15-14-23(18-29(28)41-6-2)26-20-37-30(38)21-36(19-22-10-9-11-24(17-22)40-4)33(39)34(37,3)32-31(26)25-12-7-8-13-27(25)35-32/h7-15,17-18,26,35H,5-6,16,19-21H2,1-4H3/t26?,34-/m0/s1
InChIKey
FBRNOCZVYNQCJL-BFZOCEIISA-N
Synonyms
956827-12-6
(12bS)7(3ethoxy4propoxyphenyl)2(3methoxybenzyl)12bmethyl23671212bhexahydropyrazino(1212)pyrido(34b)indole14dione
(12bS)7(3ethoxy4propoxyphenyl)2(3methoxybenzyl)12bmethyl2367tetrahydropyrazino(1212)pyrido(34b)indole14(12H12bH)dione
(2~(S))9(3ethoxy4propoxyphenyl)4((3methoxyphenyl)methyl)2methyl4717triazatetracyclo(8700^(27)0^(1116))heptadeca1(10)111315tetraene36dione
16404930
956827126
CCCOc1ccc(cc1OCC)C1CN2C(=O)CN(C(=O)(C@@)2(c2c1c1ccccc1(nH)2)C)Cc1cccc(c1)OC
InChI=1SC34H37N3O5c15164228151423(1829(28)4162)26203730(38)2136(19221091124(1722)404)33(39)34(373)3231(26)2512781327(25)3532h71517182635H56161921H214H3t26?34m0s1
MFCD06768476
ZINC000070701191
ZINC000070701193

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Available files

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