Vitas-M small molecule compound
2-(benzylsulfanyl)-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
STK531711
SMILES O=c1n(c(SCc2ccccc2)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 C26H25N3O2S MW 443.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H25N3O2S/c1-17-9-7-8-12-22(17)29-24(30)20-13-19-15-31-26(2,3)14-21(19)27-23(20)28-25(29)32-16-18-10-5-4-6-11-18/h4-13H,14-16H2,1-3H3InChIKey
BDRGWNAGEDFCAM-UHFFFAOYSA-NSynonyms
2(benzylsulfanyl)88dimethyl3(2methylphenyl)3689tetrahydro4Hpyrano(3456)pyrido(23d)pyrimidin4one
2(benzylthio)88dimethyl3(otolyl)89dihydro3Hpyrano(3456)pyrido(23d)pyrimidin4(6H)one
2benzylsulfanyl88dimethyl3(2methylphenyl)69dihydropyrano(34)pyrido(35b)pyrimidin4one
CC1=CC=CC=C1N2C(=O)C3=CC4=C(CC(OC4)(C)C)N=C3N=C2SCC5=CC=CC=C5
InChI=1SC26H25N3O2Sc1179781222(17)2924(30)201319153126(23)1421(19)2723(20)2825(29)321618105461118h413H1416H213H3
MFCD02995109
ZINC000002303251
ZINC02303251
ZINC2303251
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