Vitas-M small molecule compound
(5Z)-5-{3-chloro-4-[(3-nitrobenzyl)oxy]benzylidene}-1-(4-hydroxyphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione
Catalog ID
STL484509
SMILES Oc1ccc(cc1)N1C(=O)NC(=O)/C(=C/c2ccc(c(c2)Cl)OCc2cccc(c2)[N+](=O)[O-])/C1=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 C24H16ClN3O7 MW 493.86 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H16ClN3O7/c25-20-12-14(4-9-21(20)35-13-15-2-1-3-17(10-15)28(33)34)11-19-22(30)26-24(32)27(23(19)31)16-5-7-18(29)8-6-16/h1-12,29H,13H2,(H,26,30,32)/b19-11-InChIKey
KKJLKRUUAMOOLQ-ODLFYWEKSA-NSynonyms
(5Z)5((3chloro4((3nitrophenyl)methoxy)phenyl)methylidene)1(4hydroxyphenyl)13diazinane246trione
(5Z)5(3chloro4((3nitrobenzyl)oxy)benzylidene)1(4hydroxyphenyl)pyrimidine246(1H3H5H)trione
C1=CC(=CC(=C1)(N+)(=O)(O))COC2=C(C=C(C=C2)C=C3C(=O)NC(=O)N(C3=O)C4=CC=C(C=C4)O)Cl
InChI=1SC24H16ClN3O7c25201214(4921(20)35131521317(1015)28(33)34)111922(30)2624(32)27(23(19)31)165718(29)8616h11229H13H2(H263032)b1911
MFCD30713573
Oc1ccc(cc1)N1C(=O)NC(=O)C(=Cc2ccc(c(c2)Cl)OCc2cccc(c2)(N+)(=O)(O))C1=O
ZINC000001185057
ZINC1185057
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