Vitas-M small molecule compound

2-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-6-ethyl-3-(4-methoxyphenyl)-6-methyl-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one

Catalog ID
STK722726
SMILES CCC1(C)OCc2c(C1)c1c(s2)nc(n(c1=O)c1ccc(cc1)OC)SCC(=O)c1ccc(cc1)Cl

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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 C27H25ClN2O4S2 MW 541.09 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H25ClN2O4S2/c1-4-27(2)13-20-22(14-34-27)36-24-23(20)25(32)30(18-9-11-19(33-3)12-10-18)26(29-24)35-15-21(31)16-5-7-17(28)8-6-16/h5-12H,4,13-15H2,1-3H3
InChIKey
YPBYPRKCVPUEQA-UHFFFAOYSA-N
Synonyms

2((2(4chlorophenyl)2oxoethyl)sulfanyl)6ethyl3(4methoxyphenyl)6methyl3568tetrahydro4Hpyrano(4345)thieno(23d)pyrimidin4one
2((2(4chlorophenyl)2oxoethyl)thio)6ethyl3(4methoxyphenyl)6methyl56dihydro3Hpyrano(4345)thieno(23d)pyrimidin4(8H)one
2(2(4chlorophenyl)2oxoethyl)sulfanyl6ethyl3(4methoxyphenyl)6methyl58dihydropyrano(23)thieno(24b)pyrimidin4one
CCC1(CC2=C(CO1)SC3=C2C(=O)N(C(=N3)SCC(=O)C4=CC=C(C=C4)Cl)C5=CC=C(C=C5)OC)C
InChI=1SC27H25ClN2O4S2c1427(2)132022(143427)362423(20)25(32)30(1891119(333)121018)26(2924)351521(31)165717(28)8616h512H41315H213H3
MFCD02241314
ZINC000002298883
ZINC000002298884

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Available files

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