Vitas-M small molecule compound

N-(3-butoxypropyl)-4-[(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
STL529814
SMILES CCCCOCCCNC(=O)c1ccc(cc1)N1C(=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/c1-3-4-19-42-20-7-18-35-32(39)24-14-16-25(17-15-24)37-33(40)29-21-27-26-8-5-6-9-28(26)36-30(27)31(38(29)34(37)41)23-12-10-22(2)11-13-23/h5-6,8-17,29,31,36H,3-4,7,18-21H2,1-2H3,(H,35,39)/t29-,31?/m0/s1
InChIKey
UXSVWBGPFFSUHP-QHSFNAQHSA-N
Synonyms
956958-17-1
~(N)(3butoxypropyl)4((15~(S))10(4methylphenyl)1214dioxo81113triazatetracyclo(7700^(27)0^(1115))hexadeca1(9)246tetraen13yl)benzamide
16405322
956958171
CCCCOCCCNC(=O)c1ccc(cc1)N1C(=O)(C@H)2N(C1=O)C(c1ccc(cc1)C)c1c(C2)c2ccccc2(nH)1
InChI=1SC34H36N4O4c1341942207183532(39)24141625(171524)3733(40)29212726856928(26)3630(27)31(38(29)34(37)41)23121022(2)111323h56817293136H3471821H212H3(H3539)t2931?m0s1
MFCD06770026
N(3butoxypropyl)4((11aS)13dioxo5(ptolyl)1111adihydro1Himidazo(1516)pyrido(34b)indol2(3H5H6H)yl)benzamide
N(3butoxypropyl)4((11aS)5(4methylphenyl)13dioxo561111atetrahydro1Himidazo(1516)pyrido(34b)indol2(3H)yl)benzamide
ZINC000070701622
ZINC000070701624

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Available files

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