N-[[4-tert-butyl-1-(3,4-dichlorophenyl)piperazin-2-yl]methyl]-4-imidazol-1-yl-benzamide

Systemtic Name: N-[[4-tert-butyl-1-(3,4-dichlorophenyl)piperazin-2-yl]methyl]-4-imidazol-1-yl-benzamide Openeye Name: N-[[4-tert-butyl-1-(3,4-dichlorophenyl)piperazin-2-yl]methyl]-4-imidazol-1-yl-benzamide CAS Name: N-[[4-tert-butyl-1-(3,4-dichlorophenyl)-2-piperazinyl]methyl]-4-(1-imidazolyl)benzamide IUPAC Name: N-[[4-tert-butyl-1-(3,4-dichlorophenyl)piperazin-2-yl]methyl]-4-imidazol-1-ylbenzamide Traditional Name: N-[[4-tert-butyl-1-(3,4-dichlorophenyl)piperazin-2-yl]methyl]-4-imidazol-1-yl-benzamide Formula: C25H29Cl2N5O MolecularWeight: 486.43666

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N1CCN(C(C1)CNC(=O)C2=CC=C(C=C2)N3C=CN=C3)C4=CC(=C(C=C4)Cl)Cl

Isomeric SMILES

CC(C)(C)N1CCN(C(C1)CNC(=O)C2=CC=C(C=C2)N3C=CN=C3)C4=CC(=C(C=C4)Cl)Cl

InChI

InChI=1S/C25H29Cl2N5O/c1-25(2,3)31-12-13-32(20-8-9-22(26)23(27)14-20)21(16-31)15-29-24(33)18-4-6-19(7-5-18)30-11-10-28-17-30/h4-11,14,17,21H,12-13,15-16H2,1-3H3,(H,29,33)