Vitas-M small molecule compound
2-(4-butoxyphenyl)-6,6-dimethyl-4-[(2-methylprop-2-en-1-yl)sulfanyl]-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidine
Catalog ID
STK549607
SMILES CCCCOc1ccc(cc1)c1nc(SCC(=C)C)c2c(n1)sc1c2CC(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 C25H30N2O2S2 MW 454.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H30N2O2S2/c1-6-7-12-28-18-10-8-17(9-11-18)22-26-23(30-15-16(2)3)21-19-13-25(4,5)29-14-20(19)31-24(21)27-22/h8-11H,2,6-7,12-15H2,1,3-5H3InChIKey
NVTSDTWMDHTJKI-UHFFFAOYSA-NSynonyms
799808-89-22(4butoxyphenyl)66dimethyl4((2methylallyl)thio)68dihydro5Hpyrano(4345)thieno(23d)pyrimidine
2(4butoxyphenyl)66dimethyl4((2methylprop2en1yl)sulfanyl)58dihydro6Hpyrano(4345)thieno(23d)pyrimidine
2(4butoxyphenyl)66dimethyl4(2methylprop2enylsulfanyl)58dihydropyrano(23)thieno(24b)pyrimidine
799808892
CCCCOC1=CC=C(C=C1)C2=NC3=C(C4=C(S3)COC(C4)(C)C)C(=N2)SCC(=C)C
InChI=1SC25H30N2O2S2c16712281810817(91118)222623(301516(2)3)21191325(45)291420(19)3124(21)2722h811H2671215H2135H3
MFCD03679921
ZINC000002229509
ZINC02229509
ZINC2229509
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