Vitas-M small molecule compound
(2S)-N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[(11bS)-11b-methyl-1,3-dioxo-5,6,11,11b-tetrahydro-1H-imidazo[1',5':1,2]pyrido[3,4-b]indol-2(3H)-yl]propanamide
Catalog ID
STL545969
SMILES COc1cc(CCNC(=O)[C@@H](N2C(=O)N3[C@@](C2=O)(C)c2[nH]c4c(c2CC3)cccc4)C)ccc1OC
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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 C27H30N4O5 MW 490.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H30N4O5/c1-16(24(32)28-13-11-17-9-10-21(35-3)22(15-17)36-4)31-25(33)27(2)23-19(12-14-30(27)26(31)34)18-7-5-6-8-20(18)29-23/h5-10,15-16,29H,11-14H2,1-4H3,(H,28,32)/t16-,27-/m0/s1InChIKey
NFYZPJOFBUPGEE-OQRWROFFSA-NSynonyms
956913-07-8(2~(S))~(N)(2(34dimethoxyphenyl)ethyl)2((2~(S))2methyl35dioxo4616triazatetracyclo(7700^(26)0^(1015))hexadeca1(9)101214tetraen4yl)propanamide
(2S)N(2(34dimethoxyphenyl)ethyl)2((11bS)11bmethyl13dioxo561111btetrahydro1Himidazo(1512)pyrido(34b)indol2(3H)yl)propanamide
(S)N(34dimethoxyphenethyl)2((S)11bmethyl13dioxo56dihydro1Himidazo(1512)pyrido(34b)indol2(3H11H11bH)yl)propanamide
16400149
956913078
COc1cc(CCNC(=O)(C@@H)(N2C(=O)N3(C@@)(C2=O)(C)c2(nH)c4c(c2CC3)cccc4)C)ccc1OC
InChI=1SC27H30N4O5c116(24(32)2813111791021(353)22(1517)364)3125(33)27(2)2319(121430(27)26(31)34)18756820(18)2923h510151629H1114H214H3(H2832)t1627m0s1
ZINC000008918087
ZINC8918087
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.