Vitas-M small molecule compound
1-(3,4-dihydroisoquinolin-2(1H)-yl)-2-[(4,6-dimethylpyrimidin-2-yl)amino]-4-(methylsulfanyl)butan-1-one
Catalog ID
STL319483
SMILES CSCCC(C(=O)N1CCc2c(C1)cccc2)Nc1nc(C)cc(n1)C
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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 C20H26N4OS MW 370.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H26N4OS/c1-14-12-15(2)22-20(21-14)23-18(9-11-26-3)19(25)24-10-8-16-6-4-5-7-17(16)13-24/h4-7,12,18H,8-11,13H2,1-3H3,(H,21,22,23)InChIKey
LUPZEUNBDLLGGF-UHFFFAOYSA-NSynonyms
1401533-60-51(34dihydro1Hisoquinolin2yl)2((46dimethylpyrimidin2yl)amino)4methylsulfanylbutan1one
1(34dihydroisoquinolin2(1H)yl)2((46dimethylpyrimidin2yl)amino)4(methylsulfanyl)butan1one
1(34dihydroisoquinolin2(1H)yl)2((46dimethylpyrimidin2yl)amino)4(methylthio)butan1one
1401533605
CC1=CC(=NC(=N1)NC(CCSC)C(=O)N2CCC3=CC=CC=C3C2)C
InChI=1SC20H26N4OSc1141215(2)2220(2114)2318(911263)19(25)2410816645717(16)1324h471218H81113H213H3(H212223)
MFCD22583773
ZINC000079484036
ZINC000079484041
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