Vitas-M small molecule compound
6-[(E)-2-{2-[(4-chlorobenzyl)oxy]naphthalen-1-yl}ethenyl]-5-nitropyrimidine-2,4(1H,3H)-dione
Catalog ID
STK287099
SMILES Clc1ccc(cc1)COc1ccc2c(c1/C=C/c1[nH]c(=O)[nH]c(=O)c1[N+](=O)[O-])cccc2
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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 C23H16ClN3O5 MW 449.85 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H16ClN3O5/c24-16-8-5-14(6-9-16)13-32-20-12-7-15-3-1-2-4-17(15)18(20)10-11-19-21(27(30)31)22(28)26-23(29)25-19/h1-12H,13H2,(H2,25,26,28,29)/b11-10+InChIKey
LDMFCUACZCHJEM-ZHACJKMWSA-NSynonyms
6((E)2(2((4chlorobenzyl)oxy)naphthalen1yl)ethenyl)5nitropyrimidine24(1H3H)dione
6((E)2(2((4chlorophenyl)methoxy)naphthalen1yl)ethenyl)5nitro1Hpyrimidine24dione
C1=CC=C2C(=C1)C=CC(=C2C=CC3=C(C(=O)NC(=O)N3)(N+)(=O)(O))OCC4=CC=C(C=C4)Cl
Clc1ccc(cc1)COc1ccc2c(c1C=Cc1(nH)c(=O)(nH)c(=O)c1(N+)(=O)(O))cccc2
InChI=1SC23H16ClN3O5c24168514(6916)13322012715312417(15)18(20)10111921(27(30)31)22(28)2623(29)2519h112H13H2(H225262829)b1110+
MFCD04377923
ZINC13943457
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