Vitas-M small molecule compound

N-benzyl-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
STL533475
SMILES COc1cccc(c1)C1N2[C@@H](Cc3c1[nH]c1c3cccc1)C(=O)N(C2=O)c1ccccc1C(=O)NCc1ccccc1

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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 C34H28N4O4 MW 556.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H28N4O4/c1-42-23-13-9-12-22(18-23)31-30-26(24-14-5-7-16-27(24)36-30)19-29-33(40)38(34(41)37(29)31)28-17-8-6-15-25(28)32(39)35-20-21-10-3-2-4-11-21/h2-18,29,31,36H,19-20H2,1H3,(H,35,39)/t29-,31?/m0/s1
InChIKey
LTIYLEOWZVQMPV-QHSFNAQHSA-N
Synonyms
956937-56-7
~(N)benzyl2((15~(S))10(3methoxyphenyl)1214dioxo81113triazatetracyclo(7700^(27)0^(1115))hexadeca1(9)246tetraen13yl)benzamide
16406210
956937567
COc1cccc(c1)C1N2(C@@H)(Cc3c1(nH)c1c3cccc1)C(=O)N(C2=O)c1ccccc1C(=O)NCc1ccccc1
InChI=1SC34H28N4O4c142231391222(1823)313026(2414571627(24)3630)192933(40)38(34(41)37(29)31)2817861525(28)32(39)352021103241121h218293136H1920H21H3(H3539)t2931?m0s1
Nbenzyl2((11aS)5(3methoxyphenyl)13dioxo1111adihydro1Himidazo(1516)pyrido(34b)indol2(3H5H6H)yl)benzamide
Nbenzyl2((11aS)5(3methoxyphenyl)13dioxo561111atetrahydro1Himidazo(1516)pyrido(34b)indol2(3H)yl)benzamide
ZINC000070707209
ZINC000070707212

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Available files

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