Vitas-M small molecule compound
2-[(4-chlorobenzyl)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
STK555209
SMILES CCn1c(SCc2ccc(cc2)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 C21H22ClN3O2S MW 415.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22ClN3O2S/c1-4-25-19(26)16-9-14-11-27-21(2,3)10-17(14)23-18(16)24-20(25)28-12-13-5-7-15(22)8-6-13/h5-9H,4,10-12H2,1-3H3InChIKey
NRRIXWZTGDWFEH-UHFFFAOYSA-NSynonyms
840511-66-22((4chlorobenzyl)sulfanyl)3ethyl88dimethyl3689tetrahydro4Hpyrano(3456)pyrido(23d)pyrimidin4one
2((4chlorobenzyl)thio)3ethyl88dimethyl89dihydro3Hpyrano(3456)pyrido(23d)pyrimidin4(6H)one
2((4chlorophenyl)methylsulfanyl)3ethyl88dimethyl69dihydropyrano(34)pyrido(35b)pyrimidin4one
840511662
CCN1C(=O)C2=CC3=C(CC(OC3)(C)C)N=C2N=C1SCC4=CC=C(C=C4)Cl
InChI=1SC21H22ClN3O2Sc142519(26)16914112721(23)1017(14)2318(16)2420(25)2812135715(22)8613h59H41012H213H3
MFCD04009577
ZINC000002265710
ZINC02265710
ZINC2265710
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