Vitas-M small molecule compound
1-(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)-2-[(1-methyl-1H-benzimidazol-2-yl)sulfanyl]ethanone
Catalog ID
STK597152
SMILES COc1cc2CN(CCc2cc1OC)C(=O)CSc1nc2c(n1C)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 C21H23N3O3S MW 397.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23N3O3S/c1-23-17-7-5-4-6-16(17)22-21(23)28-13-20(25)24-9-8-14-10-18(26-2)19(27-3)11-15(14)12-24/h4-7,10-11H,8-9,12-13H2,1-3H3InChIKey
USFGFMPBNBGNDW-UHFFFAOYSA-NSynonyms
876529-75-81(67DIMETHOXY34DIHYDRO1HISOQUINOLIN2YL)2(1METHYLBENZIMIDAZOL2YL)SULFANYLETHANONE
1(67dimethoxy34dihydroisoquinolin2(1H)yl)2((1methyl1Hbenzimidazol2yl)sulfanyl)ethanone
1(67dimethoxy34dihydroisoquinolin2(1H)yl)2((1methyl1Hbenzo(d)imidazol2yl)thio)ethanone
876529758
CN1C2=CC=CC=C2N=C1SCC(=O)N3CCC4=CC(=C(C=C4C3)OC)OC
InChI=1SC21H23N3O3Sc12317754616(17)2221(23)281320(25)2498141018(262)19(273)1115(14)1224h471011H891213H213H3
MFCD03612277
ZINC000005208357
ZINC05208357
ZINC5208357
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