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-(4-phenylbutan-2-yl)pentanamide
Catalog ID
STL530451
SMILES CC(NC(=O)[C@@H](N1C(=O)N2[C@@](C1=O)(C)c1[nH]c3c(c1CC2)cccc3)CC(C)C)CCc1ccccc1
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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 C30H36N4O3 MW 500.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H36N4O3/c1-19(2)18-25(27(35)31-20(3)14-15-21-10-6-5-7-11-21)34-28(36)30(4)26-23(16-17-33(30)29(34)37)22-12-8-9-13-24(22)32-26/h5-13,19-20,25,32H,14-18H2,1-4H3,(H,31,35)/t20?,25-,30-/m0/s1InChIKey
BWWGIHOLCZWJTG-ICWLBBPSSA-NSynonyms
956824-13-8(2~(S))4methyl2((2~(S))2methyl35dioxo4616triazatetracyclo(7700^(26)0^(1015))hexadeca1(9)101214tetraen4yl)~(N)(4phenylbutan2yl)pentanamide
(2S)4methyl2((11bS)11bmethyl13dioxo561111btetrahydro1Himidazo(1512)pyrido(34b)indol2(3H)yl)N(4phenylbutan2yl)pentanamide
(2S)4methyl2((S)11bmethyl13dioxo56dihydro1Himidazo(1512)pyrido(34b)indol2(3H11H11bH)yl)N(4phenylbutan2yl)pentanamide
16402604
956824138
CC(NC(=O)(C@@H)(N1C(=O)N2(C@@)(C1=O)(C)c1(nH)c3c(c1CC2)cccc3)CC(C)C)CCc1ccccc1
InChI=1SC30H36N4O3c119(2)1825(27(35)3120(3)141521106571121)3428(36)30(4)2623(161733(30)29(34)37)2212891324(22)3226h51319202532H1418H214H3(H3135)t20?2530m0s1
MFCD06493994
ZINC000008788928
ZINC000008788930
Check stock
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Check stock on Vitas-MAvailable files
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