Vitas-M small molecule compound

1-(4-nitrobenzyl)-3-[2-oxo-2-(piperidin-1-yl)ethyl]thieno[3,2-d]pyrimidine-2,4(1H,3H)-dione

Catalog ID
STK732120
SMILES O=C(N1CCCCC1)Cn1c(=O)n(Cc2ccc(cc2)[N+](=O)[O-])c2c(c1=O)scc2

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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 C20H20N4O5S MW 428.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20N4O5S/c25-17(21-9-2-1-3-10-21)13-23-19(26)18-16(8-11-30-18)22(20(23)27)12-14-4-6-15(7-5-14)24(28)29/h4-8,11H,1-3,9-10,12-13H2
InChIKey
FUQYGGXEPGFFRY-UHFFFAOYSA-N
Synonyms
895843-29-5
1((4nitrophenyl)methyl)3(2oxo2piperidin1ylethyl)thieno(32d)pyrimidine24dione
1(4nitrobenzyl)3(2oxo2(piperidin1yl)ethyl)thieno(32d)pyrimidine24(1H3H)dione
895843295
C1CCN(CC1)C(=O)CN2C(=O)C3=C(C=CS3)N(C2=O)CC4=CC=C(C=C4)(N+)(=O)(O)
InChI=1SC20H20N4O5Sc2517(2192131021)132319(26)1816(8113018)22(20(23)27)12144615(7514)24(28)29h4811H139101213H2
MFCD08285077
O=C(N1CCCCC1)Cn1c(=O)n(Cc2ccc(cc2)(N+)(=O)(O))c2c(c1=O)scc2
ZINC000008766959
ZINC08766959
ZINC8766959

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Available files

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