Vitas-M small molecule compound

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

Catalog ID
STL537988
SMILES COc1cccc(c1OC)C1N2C(=O)CN(C(=O)[C@@H]2Cc2c1[nH]c1c2cccc1)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 C29H34N4O5 MW 518.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H34N4O5/c1-36-24-10-5-8-20(28(24)37-2)27-26-21(19-7-3-4-9-22(19)30-26)17-23-29(35)32(18-25(34)33(23)27)12-6-11-31-13-15-38-16-14-31/h3-5,7-10,23,27,30H,6,11-18H2,1-2H3/t23-,27?/m0/s1
InChIKey
PPQWQVTVDLSHNN-DCCUJTHKSA-N
Synonyms
956923-80-1
(12aS)6(23dimethoxyphenyl)2(3(morpholin4yl)propyl)23671212ahexahydropyrazino(1216)pyrido(34b)indole14dione
(12aS)6(23dimethoxyphenyl)2(3morpholinopropyl)231212atetrahydropyrazino(1216)pyrido(34b)indole14(6H7H)dione
(8~(S))2(23dimethoxyphenyl)6(3morpholin4ylpropyl)3617triazatetracyclo(8700^(38)0^(1116))heptadeca1(10)111315tetraene47dione
16399630
956923801
COc1cccc(c1OC)C1N2C(=O)CN(C(=O)(C@@H)2Cc2c1(nH)c1c2cccc1)CCCN1CCOCC1
InChI=1SC29H34N4O5c13624105820(28(24)372)272621(19734922(19)3026)172329(35)32(1825(34)33(23)27)1261131131538161431h35710232730H61118H212H3t2327?m0s1
MFCD04144745
ZINC000020411846
ZINC000020411849

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Available files

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