Vitas-M small molecule compound
2-[(2,4-dichlorobenzyl)sulfanyl]-3-ethyl-8,8-dimethyl-3,6,8,9-tetrahydro-4H-pyrano[3',4':5,6]pyrido[2,3-d]pyrimidin-4-one
Catalog ID
STK558641
SMILES CCn1c(SCc2ccc(cc2Cl)Cl)nc2c(c1=O)cc1c(n2)CC(OC1)(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 C21H21Cl2N3O2S MW 450.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21Cl2N3O2S/c1-4-26-19(27)15-7-13-10-28-21(2,3)9-17(13)24-18(15)25-20(26)29-11-12-5-6-14(22)8-16(12)23/h5-8H,4,9-11H2,1-3H3InChIKey
FSALHQLGEJEDSS-UHFFFAOYSA-NSynonyms
587001-13-62((24dichlorobenzyl)sulfanyl)3ethyl88dimethyl3689tetrahydro4Hpyrano(3456)pyrido(23d)pyrimidin4one
2((24dichlorobenzyl)thio)3ethyl88dimethyl89dihydro3Hpyrano(3456)pyrido(23d)pyrimidin4(6H)one
2((24dichlorophenyl)methylsulfanyl)3ethyl88dimethyl69dihydropyrano(34)pyrido(35b)pyrimidin4one
587001136
CCN1C(=O)C2=CC3=C(CC(OC3)(C)C)N=C2N=C1SCC4=C(C=C(C=C4)Cl)Cl
InChI=1SC21H21Cl2N3O2Sc142619(27)15713102821(23)917(13)2418(15)2520(26)2911125614(22)816(12)23h58H4911H213H3
MFCD04033594
ZINC000002397630
ZINC02397630
ZINC2397630
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