Vitas-M small molecule compound

(2S)-4-methyl-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]-N-[3-(propan-2-yloxy)propyl]pentanamide

Catalog ID
STL532692
SMILES CC(OCCCNC(=O)[C@@H](N1C(=O)N2[C@@](C1=O)(C)c1[nH]c3c(c1CC2)cccc3)CC(C)C)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 C26H36N4O4 MW 468.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H36N4O4/c1-16(2)15-21(23(31)27-12-8-14-34-17(3)4)30-24(32)26(5)22-19(11-13-29(26)25(30)33)18-9-6-7-10-20(18)28-22/h6-7,9-10,16-17,21,28H,8,11-15H2,1-5H3,(H,27,31)/t21-,26-/m0/s1
InChIKey
WPTVBPVYMMXSNO-LVXARBLLSA-N
Synonyms
956966-27-1
(2~(S))4methyl2((2~(S))2methyl35dioxo4616triazatetracyclo(7700^(26)0^(1015))hexadeca1(9)101214tetraen4yl)~(N)(3propan2yloxypropyl)pentanamide
(2S)4methyl2((11bS)11bmethyl13dioxo561111btetrahydro1Himidazo(1512)pyrido(34b)indol2(3H)yl)N(3(propan2yloxy)propyl)pentanamide
(S)N(3isopropoxypropyl)4methyl2((S)11bmethyl13dioxo56dihydro1Himidazo(1512)pyrido(34b)indol2(3H11H11bH)yl)pentanamide
16403050
956966271
CC(OCCCNC(=O)(C@@H)(N1C(=O)N2(C@@)(C1=O)(C)c1(nH)c3c(c1CC2)cccc3)CC(C)C)C
InChI=1SC26H36N4O4c116(2)1521(23(31)27128143417(3)4)3024(32)26(5)2219(111329(26)25(30)33)189671020(18)2822h6791016172128H81115H215H3(H2731)t2126m0s1
MFCD06494977
ZINC000012878997
ZINC12878997

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Available files

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