N-[(3-chloranyl-4-fluoranyl-phenyl)methyl]-2-(4-fluoranyl-2-methyl-phenyl)-N-methyl-1,4-diazepane-1-carboxamide

Systemtic Name: N-[(3-chloranyl-4-fluoranyl-phenyl)methyl]-2-(4-fluoranyl-2-methyl-phenyl)-N-methyl-1,4-diazepane-1-carboxamide Openeye Name: N-[(3-chloro-4-fluoro-phenyl)methyl]-2-(4-fluoro-2-methyl-phenyl)-N-methyl-1,4-diazepane-1-carboxamide CAS Name: N-[(3-chloro-4-fluorophenyl)methyl]-2-(4-fluoro-2-methylphenyl)-N-methyl-1,4-diazepane-1-carboxamide IUPAC Name: N-[(3-chloro-4-fluorophenyl)methyl]-2-(4-fluoro-2-methylphenyl)-N-methyl-1,4-diazepane-1-carboxamide Traditional Name: N-(3-chloro-4-fluoro-benzyl)-2-(4-fluoro-2-methyl-phenyl)-N-methyl-1,4-diazepane-1-carboxamide Formula: C21H24ClF2N3O MolecularWeight: 407.884566

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)F)C2CNCCCN2C(=O)N(C)CC3=CC(=C(C=C3)F)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)F)C2CNCCCN2C(=O)N(C)CC3=CC(=C(C=C3)F)Cl

InChI

InChI=1S/C21H24ClF2N3O/c1-14-10-16(23)5-6-17(14)20-12-25-8-3-9-27(20)21(28)26(2)13-15-4-7-19(24)18(22)11-15/h4-7,10-11,20,25H,3,8-9,12-13H2,1-2H3