N-(3-methoxyphenyl)-4-[2-(trifluoromethyl)-1,6-naphthyridin-5-yl]-1,4-diazepane-1-carboxamide

Systemtic Name: N-(3-methoxyphenyl)-4-[2-(trifluoromethyl)-1,6-naphthyridin-5-yl]-1,4-diazepane-1-carboxamide Openeye Name: N-(3-methoxyphenyl)-4-[2-(trifluoromethyl)-1,6-naphthyridin-5-yl]-1,4-diazepane-1-carboxamide CAS Name: N-(3-methoxyphenyl)-4-[2-(trifluoromethyl)-1,6-naphthyridin-5-yl]-1,4-diazepane-1-carboxamide IUPAC Name: N-(3-methoxyphenyl)-4-[2-(trifluoromethyl)-1,6-naphthyridin-5-yl]-1,4-diazepane-1-carboxamide Traditional Name: N-(3-methoxyphenyl)-4-[2-(trifluoromethyl)-1,6-naphthyridin-5-yl]-1,4-diazepane-1-carboxamide Formula: C22H22F3N5O2 MolecularWeight: 445.43759

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)NC(=O)N2CCCN(CC2)C3=NC=CC4=C3C=CC(=N4)C(F)(F)F

Isomeric SMILES

COC1=CC=CC(=C1)NC(=O)N2CCCN(CC2)C3=NC=CC4=C3C=CC(=N4)C(F)(F)F

InChI

InChI=1S/C22H22F3N5O2/c1-32-16-5-2-4-15(14-16)27-21(31)30-11-3-10-29(12-13-30)20-17-6-7-19(22(23,24)25)28-18(17)8-9-26-20/h2,4-9,14H,3,10-13H2,1H3,(H,27,31)