Vitas-M small molecule compound
2-[(1,3-benzodioxol-5-ylmethyl)sulfanyl]-8,8-dimethyl-3-(2-methylphenyl)-3,6,8,9-tetrahydro-4H-pyrano[3',4':5,6]pyrido[2,3-d]pyrimidin-4-one
Catalog ID
STK532177
SMILES O=c1n(c(SCc2ccc3c(c2)OCO3)nc2c1cc1COC(Cc1n2)(C)C)c1ccccc1C
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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 C27H25N3O4S MW 487.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H25N3O4S/c1-16-6-4-5-7-21(16)30-25(31)19-11-18-13-34-27(2,3)12-20(18)28-24(19)29-26(30)35-14-17-8-9-22-23(10-17)33-15-32-22/h4-11H,12-15H2,1-3H3InChIKey
YFUIUYKAFVCVMC-UHFFFAOYSA-NSynonyms
2((13benzodioxol5ylmethyl)sulfanyl)88dimethyl3(2methylphenyl)3689tetrahydro4Hpyrano(3456)pyrido(23d)pyrimidin4one
2((benzo(d)(13)dioxol5ylmethyl)thio)88dimethyl3(otolyl)89dihydro3Hpyrano(3456)pyrido(23d)pyrimidin4(6H)one
2(13benzodioxol5ylmethylsulfanyl)88dimethyl3(2methylphenyl)69dihydropyrano(34)pyrido(35b)pyrimidin4one
CC1=CC=CC=C1N2C(=O)C3=CC4=C(CC(OC4)(C)C)N=C3N=C2SCC5=CC6=C(C=C5)OCO6
InChI=1SC27H25N3O4Sc116645721(16)3025(31)191118133427(23)1220(18)2824(19)2926(30)351417892223(1017)33153222h411H1215H213H3
MFCD02995421
ZINC000002303637
ZINC02303637
ZINC2303637
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