4-[(4-acetamidophenyl)methyl]-N-[(2,4-dichlorophenyl)methyl]-1,4-diazepane-1-carboxamide

Systemtic Name: 4-[(4-acetamidophenyl)methyl]-N-[(2,4-dichlorophenyl)methyl]-1,4-diazepane-1-carboxamide Openeye Name: 4-[(4-acetamidophenyl)methyl]-N-[(2,4-dichlorophenyl)methyl]-1,4-diazepane-1-carboxamide CAS Name: 4-[(4-acetamidophenyl)methyl]-N-[(2,4-dichlorophenyl)methyl]-1,4-diazepane-1-carboxamide IUPAC Name: 4-[(4-acetamidophenyl)methyl]-N-[(2,4-dichlorophenyl)methyl]-1,4-diazepane-1-carboxamide Traditional Name: 4-(4-acetamidobenzyl)-N-(2,4-dichlorobenzyl)-1,4-diazepane-1-carboxamide Formula: C22H26Cl2N4O2 MolecularWeight: 449.37344

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)CN2CCCN(CC2)C(=O)NCC3=C(C=C(C=C3)Cl)Cl

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)CN2CCCN(CC2)C(=O)NCC3=C(C=C(C=C3)Cl)Cl

InChI

InChI=1S/C22H26Cl2N4O2/c1-16(29)26-20-7-3-17(4-8-20)15-27-9-2-10-28(12-11-27)22(30)25-14-18-5-6-19(23)13-21(18)24/h3-8,13H,2,9-12,14-15H2,1H3,(H,25,30)(H,26,29)