Vitas-M small molecule compound
(12aS)-6-(2,3-dimethoxyphenyl)-2-[3-(1H-imidazol-1-yl)propyl]-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Catalog ID
STL536833
SMILES COc1cccc(c1OC)C1N2C(=O)CN(C(=O)[C@@H]2Cc2c1[nH]c1c2cccc1)CCCn1ccnc1
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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 C28H29N5O4 MW 499.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H29N5O4/c1-36-23-10-5-8-19(27(23)37-2)26-25-20(18-7-3-4-9-21(18)30-25)15-22-28(35)32(16-24(34)33(22)26)13-6-12-31-14-11-29-17-31/h3-5,7-11,14,17,22,26,30H,6,12-13,15-16H2,1-2H3/t22-,26?/m0/s1InChIKey
GYGFEEPVXOTXAG-CHQVSRGASA-NSynonyms
956955-79-6(12aS)2(3(1Himidazol1yl)propyl)6(23dimethoxyphenyl)231212atetrahydropyrazino(1216)pyrido(34b)indole14(6H7H)dione
(12aS)6(23dimethoxyphenyl)2(3(1Himidazol1yl)propyl)23671212ahexahydropyrazino(1216)pyrido(34b)indole14dione
(8~(S))2(23dimethoxyphenyl)6(3imidazol1ylpropyl)3617triazatetracyclo(8700^(38)0^(1116))heptadeca1(10)111315tetraene47dione
16399857
956955796
COc1cccc(c1OC)C1N2C(=O)CN(C(=O)(C@@H)2Cc2c1(nH)c1c2cccc1)CCCn1ccnc1
InChI=1SC28H29N5O4c13623105819(27(23)372)262520(18734921(18)3025)152228(35)32(1624(34)33(22)26)13612311411291731h357111417222630H612131516H212H3t2226?m0s1
MFCD04146120
ZINC000008917926
ZINC000008918533
Check stock
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