4-(4-chlorophenyl)carbonyl-N-[(4-fluorophenyl)methyl]-1,4-diazepane-1-carboxamide

Systemtic Name: 4-(4-chlorophenyl)carbonyl-N-[(4-fluorophenyl)methyl]-1,4-diazepane-1-carboxamide Openeye Name: 4-(4-chlorobenzoyl)-N-[(4-fluorophenyl)methyl]-1,4-diazepane-1-carboxamide CAS Name: 4-[(4-chlorophenyl)-oxomethyl]-N-[(4-fluorophenyl)methyl]-1,4-diazepane-1-carboxamide IUPAC Name: 4-(4-chlorobenzoyl)-N-[(4-fluorophenyl)methyl]-1,4-diazepane-1-carboxamide Traditional Name: 4-(4-chlorobenzoyl)-N-(4-fluorobenzyl)-1,4-diazepane-1-carboxamide Formula: C20H21ClFN3O2 MolecularWeight: 389.851043

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)C(=O)NCC2=CC=C(C=C2)F)C(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

C1CN(CCN(C1)C(=O)NCC2=CC=C(C=C2)F)C(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C20H21ClFN3O2/c21-17-6-4-16(5-7-17)19(26)24-10-1-11-25(13-12-24)20(27)23-14-15-2-8-18(22)9-3-15/h2-9H,1,10-14H2,(H,23,27)