methyl 2-acetamido-3-[4-(2-azanylimidazol-1-yl)phenyl]-2-methyl-propanoate

Systemtic Name: methyl 2-acetamido-3-[4-(2-azanylimidazol-1-yl)phenyl]-2-methyl-propanoate Openeye Name: methyl 2-acetamido-3-[4-(2-aminoimidazol-1-yl)phenyl]-2-methyl-propanoate CAS Name: 2-acetamido-3-[4-(2-amino-1-imidazolyl)phenyl]-2-methylpropanoic acid methyl ester IUPAC Name: methyl 2-acetamido-3-[4-(2-aminoimidazol-1-yl)phenyl]-2-methylpropanoate Traditional Name: 2-acetamido-3-[4-(2-aminoimidazol-1-yl)phenyl]-2-methyl-propionic acid methyl ester Formula: C16H20N4O3 MolecularWeight: 316.355

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(C)(CC1=CC=C(C=C1)N2C=CN=C2N)C(=O)OC

Isomeric SMILES

CC(=O)NC(C)(CC1=CC=C(C=C1)N2C=CN=C2N)C(=O)OC

InChI

InChI=1S/C16H20N4O3/c1-11(21)19-16(2,14(22)23-3)10-12-4-6-13(7-5-12)20-9-8-18-15(20)17/h4-9H,10H2,1-3H3,(H2,17,18)(H,19,21)