Vitas-M small molecule compound
2-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-6,6-dimethyl-3-(3-methylphenyl)-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one
Catalog ID
STK720988
SMILES Cc1cccc(c1)n1c(SCC(=O)c2ccc(cc2)Cl)nc2c(c1=O)c1CC(C)(C)OCc1s2
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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 C26H23ClN2O3S2 MW 511.07 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H23ClN2O3S2/c1-15-5-4-6-18(11-15)29-24(31)22-19-12-26(2,3)32-13-21(19)34-23(22)28-25(29)33-14-20(30)16-7-9-17(27)10-8-16/h4-11H,12-14H2,1-3H3InChIKey
JFGAJNHHPNQOFR-UHFFFAOYSA-NSynonyms
371204-48-72((2(4chlorophenyl)2oxoethyl)sulfanyl)66dimethyl3(3methylphenyl)3568tetrahydro4Hpyrano(4345)thieno(23d)pyrimidin4one
2((2(4chlorophenyl)2oxoethyl)thio)66dimethyl3(mtolyl)56dihydro3Hpyrano(4345)thieno(23d)pyrimidin4(8H)one
2(2(4chlorophenyl)2oxoethyl)sulfanyl66dimethyl3(3methylphenyl)58dihydropyrano(23)thieno(24b)pyrimidin4one
371204487
CC1=CC(=CC=C1)N2C(=O)C3=C(N=C2SCC(=O)C4=CC=C(C=C4)Cl)SC5=C3CC(OC5)(C)C
InChI=1SC26H23ClN2O3S2c11554618(1115)2924(31)22191226(23)321321(19)3423(22)2825(29)331420(30)167917(27)10816h411H1214H213H3
MFCD03009510
ZINC000001757170
ZINC01757170
ZINC1757170
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