ethyl 5-azanylidene-4-[5-azanyl-1-(4-methoxyphenyl)imidazol-4-yl]-2-oxidanylidene-imidazole-1-carboxylate

Systemtic Name: ethyl 5-azanylidene-4-[5-azanyl-1-(4-methoxyphenyl)imidazol-4-yl]-2-oxidanylidene-imidazole-1-carboxylate Openeye Name: ethyl 4-[5-amino-1-(4-methoxyphenyl)imidazol-4-yl]-5-imino-2-oxo-imidazole-1-carboxylate CAS Name: 4-[5-amino-1-(4-methoxyphenyl)-4-imidazolyl]-5-imino-2-oxo-1-imidazolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[5-amino-1-(4-methoxyphenyl)imidazol-4-yl]-5-imino-2-oxoimidazole-1-carboxylate Traditional Name: 4-[5-amino-1-(4-methoxyphenyl)imidazol-4-yl]-5-imino-2-keto-3-imidazoline-1-carboxylic acid ethyl ester Formula: C16H16N6O4 MolecularWeight: 356.33604

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1C(=N)C(=NC1=O)C2=C(N(C=N2)C3=CC=C(C=C3)OC)N

Isomeric SMILES

CCOC(=O)N1C(=N)C(=NC1=O)C2=C(N(C=N2)C3=CC=C(C=C3)OC)N

InChI

InChI=1S/C16H16N6O4/c1-3-26-16(24)22-14(18)12(20-15(22)23)11-13(17)21(8-19-11)9-4-6-10(25-2)7-5-9/h4-8,18H,3,17H2,1-2H3