Vitas-M small molecule compound

1H-benzimidazol-6-yl(8-methoxy-1,3,4,5-tetrahydro-2H-pyrido[4,3-b]indol-2-yl)methanone

Catalog ID
STK637970
SMILES COc1ccc2c(c1)c1CN(CCc1[nH]2)C(=O)c1ccc2c(c1)[nH]cn2

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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 C20H18N4O2 MW 346.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18N4O2/c1-26-13-3-5-16-14(9-13)15-10-24(7-6-17(15)23-16)20(25)12-2-4-18-19(8-12)22-11-21-18/h2-5,8-9,11,23H,6-7,10H2,1H3,(H,21,22)
InChIKey
QMKSRFVGVFMXCC-UHFFFAOYSA-N
Synonyms

(1Hbenzo(d)imidazol5yl)(8methoxy34dihydro1Hpyrido(43b)indol2(5H)yl)methanone
1Hbenzimidazol6yl(8methoxy1345tetrahydro2Hpyrido(43b)indol2yl)methanone
3Hbenzimidazol5yl(8methoxy1345tetrahydropyrido(43b)indol2yl)methanone
COC1=CC2=C(C=C1)NC3=C2CN(CC3)C(=O)C4=CC5=C(C=C4)N=CN5
COc1ccc2c(c1)c1CN(CCc1(nH)2)C(=O)c1ccc2c(c1)(nH)cn2
COc1ccc2c(c1)c1CN(CCc1(nH)2)C(=O)c1ccc2c(c1)nc(nH)2
InChI=1SC20H18N4O2c12613351614(913)151024(7617(15)2316)20(25)12241819(812)22112118h25891123H6710H21H3(H2122)
MFCD18161544
ZINC000020736404
ZINC20736404

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Available files

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