Vitas-M small molecule compound
N-(1,3-dihydro-2H-benzimidazol-2-ylidene)-3-(4-methoxyphenyl)-2-methyl-1-oxo-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
Catalog ID
STK936732
SMILES COc1ccc(cc1)C1N(C)C(=O)c2c(C1C(=O)/N=c/1\[nH]c3c([nH]1)cccc3)cccc2
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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 C25H22N4O3 MW 426.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22N4O3/c1-29-22(15-11-13-16(32-2)14-12-15)21(17-7-3-4-8-18(17)24(29)31)23(30)28-25-26-19-9-5-6-10-20(19)27-25/h3-14,21-22H,1-2H3,(H2,26,27,28,30)InChIKey
XENPMCDZVARYLL-UHFFFAOYSA-NSynonyms
1190256-65-51190256655
CN1C(C(C2=CC=CC=C2C1=O)C(=O)NC3=NC4=CC=CC=C4N3)C5=CC=C(C=C5)OC
COc1ccc(cc1)C1N(C)C(=O)c2c(C1C(=O)N=c1(nH)c3c((nH)1)cccc3)cccc2
InChI=1SC25H22N4O3c12922(15111316(322)141215)21(17734818(17)24(29)31)23(30)282526199561020(19)2725h3142122H12H3(H226272830)
MFCD18178440
N(13dihydro2Hbenzimidazol2ylidene)3(4methoxyphenyl)2methyl1oxo1234tetrahydroisoquinoline4carboxamide
N(1Hbenzimidazol2yl)3(4methoxyphenyl)2methyl1oxo34dihydroisoquinoline4carboxamide
ZINC000036366577
ZINC000036366582
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