Vitas-M small molecule compound

N-(3-butoxypropyl)-2-[(11aS)-5-(4-methylphenyl)-1,3-dioxo-5,6,11,11a-tetrahydro-1H-imidazo[1',5':1,6]pyrido[3,4-b]indol-2(3H)-yl]benzamide

Catalog ID
STL530424
SMILES CCCCOCCCNC(=O)c1ccccc1N1C(=O)[C@H]2N(C1=O)C(c1ccc(cc1)C)c1c(C2)c2ccccc2[nH]1

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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 C34H36N4O4 MW 564.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H36N4O4/c1-3-4-19-42-20-9-18-35-32(39)25-11-6-8-13-28(25)38-33(40)29-21-26-24-10-5-7-12-27(24)36-30(26)31(37(29)34(38)41)23-16-14-22(2)15-17-23/h5-8,10-17,29,31,36H,3-4,9,18-21H2,1-2H3,(H,35,39)/t29-,31?/m0/s1
InChIKey
HSBKRAMCUJLMTO-QHSFNAQHSA-N
Synonyms
956947-17-4
~(N)(3butoxypropyl)2((15~(S))10(4methylphenyl)1214dioxo81113triazatetracyclo(7700^(27)0^(1115))hexadeca1(9)246tetraen13yl)benzamide
16406037
956947174
CCCCOCCCNC(=O)c1ccccc1N1C(=O)(C@H)2N(C1=O)C(c1ccc(cc1)C)c1c(C2)c2ccccc2(nH)1
InChI=1SC34H36N4O4c1341942209183532(39)2511681328(25)3833(40)2921262410571227(24)3630(26)31(37(29)34(38)41)23161422(2)151723h581017293136H3491821H212H3(H3539)t2931?m0s1
N(3butoxypropyl)2((11aS)13dioxo5(ptolyl)1111adihydro1Himidazo(1516)pyrido(34b)indol2(3H5H6H)yl)benzamide
N(3butoxypropyl)2((11aS)5(4methylphenyl)13dioxo561111atetrahydro1Himidazo(1516)pyrido(34b)indol2(3H)yl)benzamide
ZINC000070706710
ZINC000070706714

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.