tert-butyl 4-[[(3-cyanophenyl)amino]methyl]-5-methyl-imidazole-1-carboxylate

Systemtic Name: tert-butyl 4-[[(3-cyanophenyl)amino]methyl]-5-methyl-imidazole-1-carboxylate Openeye Name: tert-butyl 4-[(3-cyanoanilino)methyl]-5-methyl-imidazole-1-carboxylate CAS Name: 4-[(3-cyanoanilino)methyl]-5-methyl-1-imidazolecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[(3-cyanoanilino)methyl]-5-methylimidazole-1-carboxylate Traditional Name: 4-[(3-cyanoanilino)methyl]-5-methyl-imidazole-1-carboxylic acid tert-butyl ester Formula: C17H20N4O2 MolecularWeight: 312.3663

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=CN1C(=O)OC(C)(C)C)CNC2=CC=CC(=C2)C#N

Isomeric SMILES

CC1=C(N=CN1C(=O)OC(C)(C)C)CNC2=CC=CC(=C2)C#N

InChI

InChI=1S/C17H20N4O2/c1-12-15(10-19-14-7-5-6-13(8-14)9-18)20-11-21(12)16(22)23-17(2,3)4/h5-8,11,19H,10H2,1-4H3