N4-butyl-N2-[2-[3-[(4-cyanophenyl)methyl]imidazol-4-yl]ethyl]-N1-cyclohexyl-piperazine-1,2,4-tricarboxamide

Systemtic Name: N4-butyl-N2-[2-[3-[(4-cyanophenyl)methyl]imidazol-4-yl]ethyl]-N1-cyclohexyl-piperazine-1,2,4-tricarboxamide Openeye Name: N4-butyl-N2-[2-[3-[(4-cyanophenyl)methyl]imidazol-4-yl]ethyl]-N1-cyclohexyl-piperazine-1,2,4-tricarboxamide CAS Name: N4-butyl-N2-[2-[3-[(4-cyanophenyl)methyl]-4-imidazolyl]ethyl]-N1-cyclohexylpiperazine-1,2,4-tricarboxamide IUPAC Name: 4-N-butyl-2-N-[2-[3-[(4-cyanophenyl)methyl]imidazol-4-yl]ethyl]-1-N-cyclohexylpiperazine-1,2,4-tricarboxamide Traditional Name: N4-butyl-N2-[2-[3-(4-cyanobenzyl)imidazol-4-yl]ethyl]-N1-cyclohexyl-piperazine-1,2,4-tricarboxamide Formula: C30H42N8O3 MolecularWeight: 562.70628

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)N1CCN(C(C1)C(=O)NCCC2=CN=CN2CC3=CC=C(C=C3)C#N)C(=O)NC4CCCCC4

Isomeric SMILES

CCCCNC(=O)N1CCN(C(C1)C(=O)NCCC2=CN=CN2CC3=CC=C(C=C3)C#N)C(=O)NC4CCCCC4

InChI

InChI=1S/C30H42N8O3/c1-2-3-14-34-29(40)36-16-17-38(30(41)35-25-7-5-4-6-8-25)27(21-36)28(39)33-15-13-26-19-32-22-37(26)20-24-11-9-23(18-31)10-12-24/h9-12,19,22,25,27H,2-8,13-17,20-21H2,1H3,(H,33,39)(H,34,40)(H,35,41)