Vitas-M small molecule compound
ethyl 5-[(2Z)-2-{1-cyano-2-[(4-methoxyphenyl)amino]-2-oxoethylidene}hydrazinyl]-1H-imidazole-4-carboxylate
Catalog ID
STL438041
SMILES CCOC(=O)c1nc[nH]c1N/N=C(\C(=O)Nc1ccc(cc1)OC)/C#N
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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 C16H16N6O4 MW 356.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H16N6O4/c1-3-26-16(24)13-14(19-9-18-13)22-21-12(8-17)15(23)20-10-4-6-11(25-2)7-5-10/h4-7,9,22H,3H2,1-2H3,(H,18,19)(H,20,23)/b21-12-InChIKey
UJBPTHIFKWVFEK-MTJSOVHGSA-NSynonyms
CCOC(=O)C1=C(N=CN1)NN=C(C#N)C(=O)NC2=CC=C(C=C2)OC
CCOC(=O)c1nc(nH)c1NN=C(C(=O)Nc1ccc(cc1)OC)C#N
ETHYL4((2Z)2(1CYANO2(4METHOXYANILINO)2OXOETHYLIDENE)HYDRAZINYL)1HIMIDAZOLE5CARBOXYLATE
ethyl5((2Z)2(1cyano2((4methoxyphenyl)amino)2oxoethylidene)hydrazinyl)1Himidazole4carboxylate
InChI=1SC16H16N6O4c132616(24)1314(1991813)222112(817)15(23)20104611(252)7510h47922H3H212H3(H1819)(H2023)b2112
MFCD06240131
ZINC000005799562
ZINC101390177
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