Vitas-M small molecule compound

N-(3-butoxypropyl)-2-[(11aS)-5-(3-methoxyphenyl)-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
STL532550
SMILES CCCCOCCCNC(=O)c1ccccc1N1C(=O)[C@H]2N(C1=O)C(c1cccc(c1)OC)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 C34H36N4O5 MW 580.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H36N4O5/c1-3-4-18-43-19-10-17-35-32(39)25-14-6-8-16-28(25)38-33(40)29-21-26-24-13-5-7-15-27(24)36-30(26)31(37(29)34(38)41)22-11-9-12-23(20-22)42-2/h5-9,11-16,20,29,31,36H,3-4,10,17-19,21H2,1-2H3,(H,35,39)/t29-,31?/m0/s1
InChIKey
XJADWXTZWPXFLJ-QHSFNAQHSA-N
Synonyms
956197-42-5
~(N)(3butoxypropyl)2((15~(S))10(3methoxyphenyl)1214dioxo81113triazatetracyclo(7700^(27)0^(1115))hexadeca1(9)246tetraen13yl)benzamide
16405734
956197425
CCCCOCCCNC(=O)c1ccccc1N1C(=O)(C@H)2N(C1=O)C(c1cccc(c1)OC)c1c(C2)c2ccccc2(nH)1
InChI=1SC34H36N4O5c13418431910173532(39)2514681628(25)3833(40)2921262413571527(24)3630(26)31(37(29)34(38)41)221191223(2022)422h59111620293136H3410171921H212H3(H3539)t2931?m0s1
N(3butoxypropyl)2((11aS)5(3methoxyphenyl)13dioxo1111adihydro1Himidazo(1516)pyrido(34b)indol2(3H5H6H)yl)benzamide
N(3butoxypropyl)2((11aS)5(3methoxyphenyl)13dioxo561111atetrahydro1Himidazo(1516)pyrido(34b)indol2(3H)yl)benzamide
ZINC000070705493
ZINC000070705495

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Available files

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