Vitas-M small molecule compound
N-(4-butoxyphenyl)-4-[(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]benzamide
Catalog ID
STL537656
SMILES CCCCOc1ccc(cc1)NC(=O)c1ccc(cc1)N1C(=O)N2[C@@](C1=O)(C)c1[nH]c3c(c1CC2)cccc3
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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 C31H30N4O4 MW 522.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H30N4O4/c1-3-4-19-39-23-15-11-21(12-16-23)32-28(36)20-9-13-22(14-10-20)35-29(37)31(2)27-25(17-18-34(31)30(35)38)24-7-5-6-8-26(24)33-27/h5-16,33H,3-4,17-19H2,1-2H3,(H,32,36)/t31-/m0/s1InChIKey
VKAYQYCSIYIFCP-HKBQPEDESA-NSynonyms
956947-62-9(S)N(4butoxyphenyl)4(11bmethyl13dioxo56dihydro1Himidazo(1512)pyrido(34b)indol2(3H11H11bH)yl)benzamide
~(N)(4butoxyphenyl)4((2~(S))2methyl35dioxo4616triazatetracyclo(7700^(26)0^(1015))hexadeca1(9)101214tetraen4yl)benzamide
16400971
956947629
CCCCOc1ccc(cc1)NC(=O)c1ccc(cc1)N1C(=O)N2(C@@)(C1=O)(C)c1(nH)c3c(c1CC2)cccc3
InChI=1SC31H30N4O4c134193923151121(121623)3228(36)2091322(141020)3529(37)31(2)2725(171834(31)30(35)38)24756826(24)3327h51633H341719H212H3(H3236)t31m0s1
MFCD05672321
N(4butoxyphenyl)4((11bS)11bmethyl13dioxo561111btetrahydro1Himidazo(1512)pyrido(34b)indol2(3H)yl)benzamide
ZINC000008918484
ZINC8918484
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