ethyl 2-[[2-azanyl-5-(2,4-dimethylimidazol-1-yl)-3-methyl-phenyl]methyl-cyano-amino]ethanoate

Systemtic Name: ethyl 2-[[2-azanyl-5-(2,4-dimethylimidazol-1-yl)-3-methyl-phenyl]methyl-cyano-amino]ethanoate Openeye Name: ethyl 2-[[2-amino-5-(2,4-dimethylimidazol-1-yl)-3-methyl-phenyl]methyl-cyano-amino]acetate CAS Name: 2-[[2-amino-5-(2,4-dimethyl-1-imidazolyl)-3-methylphenyl]methyl-cyanoamino]acetic acid ethyl ester IUPAC Name: ethyl 2-[[2-amino-5-(2,4-dimethylimidazol-1-yl)-3-methylphenyl]methyl-cyanoamino]acetate Traditional Name: 2-[[2-amino-5-(2,4-dimethylimidazol-1-yl)-3-methyl-benzyl]-cyano-amino]acetic acid ethyl ester Formula: C18H23N5O2 MolecularWeight: 341.40752

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN(CC1=C(C(=CC(=C1)N2C=C(N=C2C)C)C)N)C#N

Isomeric SMILES

CCOC(=O)CN(CC1=C(C(=CC(=C1)N2C=C(N=C2C)C)C)N)C#N

InChI

InChI=1S/C18H23N5O2/c1-5-25-17(24)10-22(11-19)9-15-7-16(6-12(2)18(15)20)23-8-13(3)21-14(23)4/h6-8H,5,9-10,20H2,1-4H3