methyl 2-[2-(cyanoamino)-5-oxidanylidene-1-(phenylmethyl)-4H-imidazol-4-yl]ethanoate

Systemtic Name: methyl 2-[2-(cyanoamino)-5-oxidanylidene-1-(phenylmethyl)-4H-imidazol-4-yl]ethanoate Openeye Name: methyl 2-[1-benzyl-2-(cyanoamino)-5-oxo-4H-imidazol-4-yl]acetate CAS Name: 2-[2-(cyanoamino)-5-oxo-1-(phenylmethyl)-4H-imidazol-4-yl]acetic acid methyl ester IUPAC Name: methyl 2-[1-benzyl-2-(cyanoamino)-5-oxo-4H-imidazol-4-yl]acetate Traditional Name: 2-[1-benzyl-2-(cyanoamino)-5-keto-2-imidazolin-4-yl]acetic acid methyl ester Formula: C14H14N4O3 MolecularWeight: 286.28596

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC1C(=O)N(C(=N1)NC#N)CC2=CC=CC=C2

Isomeric SMILES

COC(=O)CC1C(=O)N(C(=N1)NC#N)CC2=CC=CC=C2

InChI

InChI=1S/C14H14N4O3/c1-21-12(19)7-11-13(20)18(14(17-11)16-9-15)8-10-5-3-2-4-6-10/h2-6,11H,7-8H2,1H3,(H,16,17)