Vitas-M small molecule compound
(2E)-2-cyano-2-[2-(1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)hydrazinylidene]-N-(4-methoxyphenyl)ethanamide
Catalog ID
STK806417
SMILES N#C/C(=N\Nc1[nH]c2c(n1)n(C)c(=O)n(c2=O)C)/C(=O)Nc1ccc(cc1)OC
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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 C17H16N8O4 MW 396.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16N8O4/c1-24-13-12(15(27)25(2)17(24)28)20-16(21-13)23-22-11(8-18)14(26)19-9-4-6-10(29-3)7-5-9/h4-7H,1-3H3,(H,19,26)(H2,20,21,23)/b22-11+InChIKey
SSBJADMWNNBGFZ-SSDVNMTOSA-NSynonyms
(1E)N((13DIMETHYL26DIOXO7HPURIN8YL)AMINO)2(4METHOXYANILINO)2OXOETHANIMIDOYLCYANIDE
(2E)2cyano2(2(13dimethyl26dioxo2367tetrahydro1Hpurin8yl)hydrazinylidene)N(4methoxyphenyl)ethanamide
(Z)N(13dimethyl26dioxo2367tetrahydro1Hpurin8yl)2((4methoxyphenyl)amino)2oxoacetohydrazonoylcyanide
CN1C2=C(C(=O)N(C1=O)C)NC(=N2)NN=C(C#N)C(=O)NC3=CC=C(C=C3)OC
InChI=1SC17H16N8O4c1241312(15(27)25(2)17(24)28)2016(2113)232211(818)14(26)1994610(293)759h47H13H3(H1926)(H2202123)b2211+
MFCD18169562
N#CC(=NNc1(nH)c2c(n1)n(C)c(=O)n(c2=O)C)C(=O)Nc1ccc(cc1)OC
ZINC000008661033
ZINC08661033
ZINC100699773
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