Vitas-M small molecule compound
4-{[7-(2,4-dichlorobenzyl)-1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl]oxy}benzonitrile
Catalog ID
STK234892
SMILES N#Cc1ccc(cc1)Oc1nc2c(n1Cc1ccc(cc1Cl)Cl)c(=O)n(c(=O)n2C)C
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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 C21H15Cl2N5O3 MW 456.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H15Cl2N5O3/c1-26-18-17(19(29)27(2)21(26)30)28(11-13-5-6-14(22)9-16(13)23)20(25-18)31-15-7-3-12(10-24)4-8-15/h3-9H,11H2,1-2H3InChIKey
DVWUBKYEHPHBQP-UHFFFAOYSA-NSynonyms
4((7(24dichlorobenzyl)13dimethyl26dioxo2367tetrahydro1Hpurin8yl)oxy)benzonitrile
4(7((24DICHLOROPHENYL)METHYL)13DIMETHYL26DIOXOPURIN8YL)OXYBENZONITRILE
CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)OC3=CC=C(C=C3)C#N)CC4=C(C=C(C=C4)Cl)Cl
InChI=1SC21H15Cl2N5O3c1261817(19(29)27(2)21(26)30)28(11135614(22)916(13)23)20(2518)31157312(1024)4815h39H11H212H3
MFCD06124834
ZINC000008606336
ZINC08606336
ZINC8606336
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