4-(1,6-naphthyridin-2-ylcarbonyl)-N-[3-(trifluoromethyl)phenyl]-1,4-diazepane-1-carboxamide

Systemtic Name: 4-(1,6-naphthyridin-2-ylcarbonyl)-N-[3-(trifluoromethyl)phenyl]-1,4-diazepane-1-carboxamide Openeye Name: 4-(1,6-naphthyridine-2-carbonyl)-N-[3-(trifluoromethyl)phenyl]-1,4-diazepane-1-carboxamide CAS Name: 4-[1,6-naphthyridin-2-yl(oxo)methyl]-N-[3-(trifluoromethyl)phenyl]-1,4-diazepane-1-carboxamide IUPAC Name: 4-(1,6-naphthyridine-2-carbonyl)-N-[3-(trifluoromethyl)phenyl]-1,4-diazepane-1-carboxamide Traditional Name: 4-(1,6-naphthyridine-2-carbonyl)-N-[3-(trifluoromethyl)phenyl]-1,4-diazepane-1-carboxamide Formula: C22H20F3N5O2 MolecularWeight: 443.42171

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)C(=O)NC2=CC=CC(=C2)C(F)(F)F)C(=O)C3=NC4=C(C=C3)C=NC=C4

Isomeric SMILES

C1CN(CCN(C1)C(=O)NC2=CC=CC(=C2)C(F)(F)F)C(=O)C3=NC4=C(C=C3)C=NC=C4

InChI

InChI=1S/C22H20F3N5O2/c23-22(24,25)16-3-1-4-17(13-16)27-21(32)30-10-2-9-29(11-12-30)20(31)19-6-5-15-14-26-8-7-18(15)28-19/h1,3-8,13-14H,2,9-12H2,(H,27,32)