Vitas-M small molecule compound
(2S)-N-(3-butoxypropyl)-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
STL532468
SMILES CCCCOCCCNC(=O)[C@@H](N1C(=O)N2[C@@](C1=O)(C)c1[nH]c3c(c1CC2)cccc3)CC(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 C27H38N4O4 MW 482.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H38N4O4/c1-5-6-15-35-16-9-13-28-24(32)22(17-18(2)3)31-25(33)27(4)23-20(12-14-30(27)26(31)34)19-10-7-8-11-21(19)29-23/h7-8,10-11,18,22,29H,5-6,9,12-17H2,1-4H3,(H,28,32)/t22-,27-/m0/s1InChIKey
SOLJRLWFADHTGR-CUNXSJBXSA-NSynonyms
956992-51-1(2~(S))~(N)(3butoxypropyl)4methyl2((2~(S))2methyl35dioxo4616triazatetracyclo(7700^(26)0^(1015))hexadeca1(9)101214tetraen4yl)pentanamide
(2S)N(3butoxypropyl)4methyl2((11bS)11bmethyl13dioxo561111btetrahydro1Himidazo(1512)pyrido(34b)indol2(3H)yl)pentanamide
(S)N(3butoxypropyl)4methyl2((S)11bmethyl13dioxo56dihydro1Himidazo(1512)pyrido(34b)indol2(3H11H11bH)yl)pentanamide
16402598
956992511
CCCCOCCCNC(=O)(C@@H)(N1C(=O)N2(C@@)(C1=O)(C)c1(nH)c3c(c1CC2)cccc3)CC(C)C
InChI=1SC27H38N4O4c1561535169132824(32)22(1718(2)3)3125(33)27(4)2320(121430(27)26(31)34)1910781121(19)2923h781011182229H5691217H214H3(H2832)t2227m0s1
ZINC000008788914
ZINC8788914
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