Vitas-M small molecule compound
2-{[2-(4-methoxyphenyl)-7,7-dimethyl-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl]sulfanyl}-1-(piperidin-1-yl)ethanone
Catalog ID
STK578545
SMILES COc1ccc(cc1)c1nc(SCC(=O)N2CCCCC2)c2c(n1)CC(OC2)(C)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 C23H29N3O3S MW 427.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H29N3O3S/c1-23(2)13-19-18(14-29-23)22(30-15-20(27)26-11-5-4-6-12-26)25-21(24-19)16-7-9-17(28-3)10-8-16/h7-10H,4-6,11-15H2,1-3H3InChIKey
DEKUQZRNPBRZAB-UHFFFAOYSA-NSynonyms
900894-22-62((2(4METHOXYPHENYL)77DIMETHYL58DIHYDROPYRANO(43D)PYRIMIDIN4YL)SULFANYL)1PIPERIDIN1YLETHANONE
2((2(4methoxyphenyl)77dimethyl78dihydro5Hpyrano(43d)pyrimidin4yl)sulfanyl)1(piperidin1yl)ethanone
2((2(4methoxyphenyl)77dimethyl78dihydro5Hpyrano(43d)pyrimidin4yl)thio)1(piperidin1yl)ethanone
900894226
CC1(CC2=C(CO1)C(=NC(=N2)C3=CC=C(C=C3)OC)SCC(=O)N4CCCCC4)C
InChI=1SC23H29N3O3Sc123(2)131918(142923)22(301520(27)26115461226)2521(2419)167917(283)10816h710H461115H213H3
MFCD06777431
ZINC000005270303
ZINC05270303
ZINC5270303
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