Vitas-M small molecule compound

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

Catalog ID
STK603723
SMILES O=C(N1CCCCC1)Cn1c(=O)c2sccc2n(c1=O)Cc1cccc(c1)[N+](=O)[O-]

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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(21-8-2-1-3-9-21)13-23-19(26)18-16(7-10-30-18)22(20(23)27)12-14-5-4-6-15(11-14)24(28)29/h4-7,10-11H,1-3,8-9,12-13H2
InChIKey
MLFYICGBDMKHPC-UHFFFAOYSA-N
Synonyms
895836-14-3
1((3nitrophenyl)methyl)3(2oxo2piperidin1ylethyl)thieno(32d)pyrimidine24dione
1(3nitrobenzyl)3(2oxo2(piperidin1yl)ethyl)thieno(32d)pyrimidine24(1H3H)dione
895836143
C1CCN(CC1)C(=O)CN2C(=O)C3=C(C=CS3)N(C2=O)CC4=CC(=CC=C4)(N+)(=O)(O)
InChI=1SC20H20N4O5Sc2517(218213921)132319(26)1816(7103018)22(20(23)27)121454615(1114)24(28)29h471011H13891213H2
MFCD08286304
O=C(N1CCCCC1)Cn1c(=O)c2sccc2n(c1=O)Cc1cccc(c1)(N+)(=O)(O)
ZINC000008769274
ZINC08769274
ZINC8769274

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Available files

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