tert-butyl 3-[2-[3-[(4-cyanophenyl)methyl]imidazol-4-yl]ethylcarbamoyl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 3-[2-[3-[(4-cyanophenyl)methyl]imidazol-4-yl]ethylcarbamoyl]piperidine-1-carboxylate Openeye Name: tert-butyl 3-[2-[3-[(4-cyanophenyl)methyl]imidazol-4-yl]ethylcarbamoyl]piperidine-1-carboxylate CAS Name: 3-[[2-[3-[(4-cyanophenyl)methyl]-4-imidazolyl]ethylamino]-oxomethyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-[2-[3-[(4-cyanophenyl)methyl]imidazol-4-yl]ethylcarbamoyl]piperidine-1-carboxylate Traditional Name: 3-[2-[3-(4-cyanobenzyl)imidazol-4-yl]ethylcarbamoyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C24H31N5O3 MolecularWeight: 437.53464

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCCC(C1)C(=O)NCCC2=CN=CN2CC3=CC=C(C=C3)C#N

Isomeric SMILES

CC(C)(C)OC(=O)N1CCCC(C1)C(=O)NCCC2=CN=CN2CC3=CC=C(C=C3)C#N

InChI

InChI=1S/C24H31N5O3/c1-24(2,3)32-23(31)28-12-4-5-20(16-28)22(30)27-11-10-21-14-26-17-29(21)15-19-8-6-18(13-25)7-9-19/h6-9,14,17,20H,4-5,10-12,15-16H2,1-3H3,(H,27,30)