Vitas-M small molecule compound
(2S)-N-(2-chloro-6-fluorobenzyl)-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]pentanamide
Catalog ID
STL530037
SMILES CC(C[C@H](N1C(=O)N2[C@@](C1=O)(C)c1[nH]c3c(c1CC2)cccc3)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 C27H28ClFN4O3 MW 511.00 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H28ClFN4O3/c1-15(2)13-22(24(34)30-14-18-19(28)8-6-9-20(18)29)33-25(35)27(3)23-17(11-12-32(27)26(33)36)16-7-4-5-10-21(16)31-23/h4-10,15,22,31H,11-14H2,1-3H3,(H,30,34)/t22-,27-/m0/s1InChIKey
UXGUFLXOUKXKHV-CUNXSJBXSA-NSynonyms
956966-53-3(2~(S))~(N)((2chloro6fluorophenyl)methyl)4methyl2((2~(S))2methyl35dioxo4616triazatetracyclo(7700^(26)0^(1015))hexadeca1(9)101214tetraen4yl)pentanamide
(2S)N(2chloro6fluorobenzyl)4methyl2((11bS)11bmethyl13dioxo561111btetrahydro1Himidazo(1512)pyrido(34b)indol2(3H)yl)pentanamide
(S)N(2chloro6fluorobenzyl)4methyl2((S)11bmethyl13dioxo56dihydro1Himidazo(1512)pyrido(34b)indol2(3H11H11bH)yl)pentanamide
16402263
956966533
CC(C(C@H)(N1C(=O)N2(C@@)(C1=O)(C)c1(nH)c3c(c1CC2)cccc3)C(=O)NCc1c(F)cccc1Cl)C
InChI=1SC27H28ClFN4O3c115(2)1322(24(34)30141819(28)86920(18)29)3325(35)27(3)2317(111232(27)26(33)36)167451021(16)3123h410152231H1114H213H3(H3034)t2227m0s1
MFCD06493269
ZINC000012875599
ZINC12875599
Check stock
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Check stock on Vitas-MAvailable files
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