Vitas-M small molecule compound

[6,6-dimethyl-2,4-dioxo-1-(2-phenylethyl)-1,5,6,8-tetrahydro-2H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-3(4H)-yl]acetic acid

Catalog ID
STK611434
SMILES OC(=O)Cn1c(=O)n(CCc2ccccc2)c2c(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 C21H22N2O5S MW 414.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N2O5S/c1-21(2)10-14-15(12-28-21)29-19-17(14)18(26)23(11-16(24)25)20(27)22(19)9-8-13-6-4-3-5-7-13/h3-7H,8-12H2,1-2H3,(H,24,25)
InChIKey
HZXJPCZAXIARTF-UHFFFAOYSA-N
Synonyms
903862-27-1
(66dimethyl24dioxo1(2phenylethyl)1568tetrahydro2Hpyrano(4345)thieno(23d)pyrimidin3(4H)yl)aceticacid
2(66dimethyl24dioxo1(2phenylethyl)58dihydropyrano(23)thieno(24b)pyrimidin3yl)aceticacid
2(66dimethyl24dioxo1phenethyl56dihydro1Hpyrano(4345)thieno(23d)pyrimidin3(2H4H8H)yl)aceticacid
903862271
CC1(CC2=C(CO1)SC3=C2C(=O)N(C(=O)N3CCC4=CC=CC=C4)CC(=O)O)C
InChI=1SC21H22N2O5Sc121(2)101415(122821)291917(14)18(26)23(1116(24)25)20(27)22(19)98136435713h37H812H212H3(H2425)
MFCD08286951
ZINC000006670117
ZINC6670117

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Available files

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