Vitas-M small molecule compound
ethyl 5-[(2E)-2-{1-cyano-2-[(2-methoxyphenyl)amino]-2-oxoethylidene}hydrazinyl]-1H-imidazole-4-carboxylate
Catalog ID
STL446428
SMILES CCOC(=O)c1nc[nH]c1N/N=C(/C(=O)Nc1ccccc1OC)\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)22-21-11(8-17)15(23)20-10-6-4-5-7-12(10)25-2/h4-7,9,22H,3H2,1-2H3,(H,18,19)(H,20,23)/b21-11+InChIKey
JYMQEKJZWSLZMJ-SRZZPIQSSA-NSynonyms
CCOC(=O)C1=C(N=CN1)NN=C(C#N)C(=O)NC2=CC=CC=C2OC
CCOC(=O)c1nc(nH)c1NN=C(C(=O)Nc1ccccc1OC)C#N
ETHYL4((2E)2(1CYANO2(2METHOXYANILINO)2OXOETHYLIDENE)HYDRAZINYL)1HIMIDAZOLE5CARBOXYLATE
ethyl5((2E)2(1cyano2((2methoxyphenyl)amino)2oxoethylidene)hydrazinyl)1Himidazole4carboxylate
InChI=1SC16H16N6O4c132616(24)1314(1991813)222111(817)15(23)2010645712(10)252h47922H3H212H3(H1819)(H2023)b2111+
MFCD06240315
ZINC000004635224
ZINC101390174
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