3-azanyl-N-[4-[(cyclohexylamino)methyl]phenyl]-4,5-bis(1H-imidazol-2-ylmethyl)-2-methyl-benzamide

Systemtic Name: 3-azanyl-N-[4-[(cyclohexylamino)methyl]phenyl]-4,5-bis(1H-imidazol-2-ylmethyl)-2-methyl-benzamide Openeye Name: 3-amino-N-[4-[(cyclohexylamino)methyl]phenyl]-4,5-bis(1H-imidazol-2-ylmethyl)-2-methyl-benzamide CAS Name: 3-amino-N-[4-[(cyclohexylamino)methyl]phenyl]-4,5-bis(1H-imidazol-2-ylmethyl)-2-methylbenzamide IUPAC Name: 3-amino-N-[4-[(cyclohexylamino)methyl]phenyl]-4,5-bis(1H-imidazol-2-ylmethyl)-2-methylbenzamide Traditional Name: 3-amino-N-[4-[(cyclohexylamino)methyl]phenyl]-4,5-bis(1H-imidazol-2-ylmethyl)-2-methyl-benzamide Formula: C29H35N7O MolecularWeight: 497.6345

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1C(=O)NC2=CC=C(C=C2)CNC3CCCCC3)CC4=NC=CN4)CC5=NC=CN5)N

Isomeric SMILES

CC1=C(C(=C(C=C1C(=O)NC2=CC=C(C=C2)CNC3CCCCC3)CC4=NC=CN4)CC5=NC=CN5)N

InChI

InChI=1S/C29H35N7O/c1-19-24(29(37)36-23-9-7-20(8-10-23)18-35-22-5-3-2-4-6-22)15-21(16-26-31-11-12-32-26)25(28(19)30)17-27-33-13-14-34-27/h7-15,22,35H,2-6,16-18,30H2,1H3,(H,31,32)(H,33,34)(H,36,37)