Vitas-M small molecule compound
3-(4-methoxyphenyl)-2-[(2-methylprop-2-en-1-yl)sulfanyl]-3,5,6,7,8,9-hexahydro-4H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4-one
Catalog ID
STK829937
SMILES COc1ccc(cc1)n1c(SCC(=C)C)nc2c(c1=O)c1CCCCCc1s2
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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 C22H24N2O2S2 MW 412.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H24N2O2S2/c1-14(2)13-27-22-23-20-19(17-7-5-4-6-8-18(17)28-20)21(25)24(22)15-9-11-16(26-3)12-10-15/h9-12H,1,4-8,13H2,2-3H3InChIKey
OCWYOOPJXDFROV-UHFFFAOYSA-NSynonyms
351160-21-93(4methoxyphenyl)2((2methylallyl)thio)6789tetrahydro3Hcyclohepta(45)thieno(23d)pyrimidin4(5H)one
3(4methoxyphenyl)2((2methylprop2en1yl)sulfanyl)356789hexahydro4Hcyclohepta(45)thieno(23d)pyrimidin4one
3(4methoxyphenyl)2(2methylprop2enylsulfanyl)6789tetrahydro5Hcyclohepta(23)thieno(24b)pyrimidin4one
351160219
CC(=C)CSC1=NC2=C(C3=C(S2)CCCCC3)C(=O)N1C4=CC=C(C=C4)OC
InChI=1SC22H24N2O2S2c114(2)132722232019(177546818(17)2820)21(25)24(22)1591116(263)121015h912H14813H223H3
MFCD01876490
ZINC000002271833
ZINC02271833
ZINC2271833
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