Vitas-M small molecule compound

N-(4-fluorophenyl)-2-[1-(4-nitrobenzyl)-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl]acetamide

Catalog ID
STK614855
SMILES O=C(Cn1c(=O)n(Cc2ccc(cc2)[N+](=O)[O-])c2c(c1=O)scc2)Nc1ccc(cc1)F

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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 C21H15FN4O5S MW 454.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H15FN4O5S/c22-14-3-5-15(6-4-14)23-18(27)12-25-20(28)19-17(9-10-32-19)24(21(25)29)11-13-1-7-16(8-2-13)26(30)31/h1-10H,11-12H2,(H,23,27)
InChIKey
CQSPARQNGAPQIJ-UHFFFAOYSA-N
Synonyms
895835-54-8
895835548
C1=CC(=CC=C1CN2C3=C(C(=O)N(C2=O)CC(=O)NC4=CC=C(C=C4)F)SC=C3)(N+)(=O)(O)
InChI=1SC21H15FN4O5Sc22143515(6414)2318(27)122520(28)1917(9103219)24(21(25)29)11131716(8213)26(30)31h110H1112H2(H2327)
MFCD08287681
N(4fluorophenyl)2(1((4nitrophenyl)methyl)24dioxothieno(32d)pyrimidin3yl)acetamide
N(4fluorophenyl)2(1(4nitrobenzyl)24dioxo12dihydrothieno(32d)pyrimidin3(4H)yl)acetamide
N(4fluorophenyl)2(1(4nitrobenzyl)24dioxo14dihydrothieno(32d)pyrimidin3(2H)yl)acetamide
O=C(Cn1c(=O)n(Cc2ccc(cc2)(N+)(=O)(O))c2c(c1=O)scc2)Nc1ccc(cc1)F
ZINC000008769219
ZINC08769219
ZINC8769219

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Available files

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