Vitas-M small molecule compound
N-[2-(cyclohex-1-en-1-yl)ethyl]-3-[(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
STL538165
SMILES O=C(c1cccc(c1)N1C(=O)N2[C@@](C1=O)(C)c1[nH]c3c(c1CC2)cccc3)NCCC1=CCCCC1
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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 C29H30N4O3 MW 482.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H30N4O3/c1-29-25-23(22-12-5-6-13-24(22)31-25)15-17-32(29)28(36)33(27(29)35)21-11-7-10-20(18-21)26(34)30-16-14-19-8-3-2-4-9-19/h5-8,10-13,18,31H,2-4,9,14-17H2,1H3,(H,30,34)/t29-/m0/s1InChIKey
OOYSOFCSGNWVNL-LJAQVGFWSA-NSynonyms
956746-90-0(S)N(2(cyclohex1en1yl)ethyl)3(11bmethyl13dioxo56dihydro1Himidazo(1512)pyrido(34b)indol2(3H11H11bH)yl)benzamide
~(N)(2(cyclohexen1yl)ethyl)3((2~(S))2methyl35dioxo4616triazatetracyclo(7700^(26)0^(1015))hexadeca1(9)101214tetraen4yl)benzamide
6570520
956746900
InChI=1SC29H30N4O3c1292523(2212561324(22)3125)151732(29)28(36)33(27(29)35)211171020(1821)26(34)301614198324919h5810131831H2491417H21H3(H3034)t29m0s1
MFCD05670962
N(2(cyclohex1en1yl)ethyl)3((11bS)11bmethyl13dioxo561111btetrahydro1Himidazo(1512)pyrido(34b)indol2(3H)yl)benzamide
O=C(c1cccc(c1)N1C(=O)N2(C@@)(C1=O)(C)c1(nH)c3c(c1CC2)cccc3)NCCC1=CCCCC1
ZINC000008918096
ZINC8918096
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.