Vitas-M small molecule compound

(2S)-N-(2-chloro-6-fluorobenzyl)-2-[(11bS)-8-methoxy-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
STL529304
SMILES COc1ccc2c(c1)c1CCN3[C@](c1[nH]2)(C)C(=O)N(C3=O)[C@H](C(=O)NCc1c(F)cccc1Cl)C

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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 C25H24ClFN4O4 MW 498.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H24ClFN4O4/c1-13(22(32)28-12-17-18(26)5-4-6-19(17)27)31-23(33)25(2)21-15(9-10-30(25)24(31)34)16-11-14(35-3)7-8-20(16)29-21/h4-8,11,13,29H,9-10,12H2,1-3H3,(H,28,32)/t13-,25-/m0/s1
InChIKey
XVDIAKCGOUAGKN-CANCMXDXSA-N
Synonyms
956919-01-0
(2~(S))~(N)((2chloro6fluorophenyl)methyl)2((2~(S))12methoxy2methyl35dioxo4616triazatetracyclo(7700^(26)0^(1015))hexadeca1(9)10(15)1113tetraen4yl)propanamide
(2S)N(2chloro6fluorobenzyl)2((11bS)8methoxy11bmethyl13dioxo561111btetrahydro1Himidazo(1512)pyrido(34b)indol2(3H)yl)propanamide
(S)N(2chloro6fluorobenzyl)2((S)8methoxy11bmethyl13dioxo56dihydro1Himidazo(1512)pyrido(34b)indol2(3H11H11bH)yl)propanamide
16401842
956919010
COc1ccc2c(c1)c1CCN3(C@)(c1(nH)2)(C)C(=O)N(C3=O)(C@H)(C(=O)NCc1c(F)cccc1Cl)C
InChI=1SC25H24ClFN4O4c113(22(32)28121718(26)54619(17)27)3123(33)25(2)2115(91030(25)24(31)34)161114(353)7820(16)2921h48111329H91012H213H3(H2832)t1325m0s1
ZINC000008952771

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Available files

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