Vitas-M small molecule compound
6-[(Z)-2-{5-chloro-2-[(3-chlorobenzyl)oxy]phenyl}ethenyl]-5-nitropyrimidine-2,4(1H,3H)-dione
Catalog ID
STK287091
SMILES Clc1ccc(c(c1)/C=C\c1[nH]c(=O)[nH]c(=O)c1[N+](=O)[O-])OCc1cccc(c1)Cl
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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 C19H13Cl2N3O5 MW 434.23 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H13Cl2N3O5/c20-13-3-1-2-11(8-13)10-29-16-7-5-14(21)9-12(16)4-6-15-17(24(27)28)18(25)23-19(26)22-15/h1-9H,10H2,(H2,22,23,25,26)/b6-4-InChIKey
SCZRPYDMSXQHON-XQRVVYSFSA-NSynonyms
6((Z)2(5CHLORO2((3CHLOROBENZYL)OXY)PHENYL)ETHENYL)5NITROPYRIMIDINE24(1H3H)DIONE
6((Z)2(5CHLORO2((3CHLOROPHENYL)METHOXY)PHENYL)ETHENYL)5NITRO1HPYRIMIDINE24DIONE
C1=CC(=CC(=C1)Cl)COC2=C(C=C(C=C2)Cl)C=CC3=C(C(=O)NC(=O)N3)(N+)(=O)(O)
Clc1ccc(c(c1)C=Cc1(nH)c(=O)(nH)c(=O)c1(N+)(=O)(O))OCc1cccc(c1)Cl
InChI=1SC19H13Cl2N3O5c201331211(813)1029167514(21)912(16)461517(24(27)28)18(25)2319(26)2215h19H10H2(H222232526)b64
MFCD04392548
ZINC000030840525
ZINC30840525
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