8-phenyl-5-[4-(pyridin-3-ylmethyl)-1,4-diazepan-1-yl]-2-(trifluoromethyl)-1,6-naphthyridine

Systemtic Name: 8-phenyl-5-[4-(pyridin-3-ylmethyl)-1,4-diazepan-1-yl]-2-(trifluoromethyl)-1,6-naphthyridine Openeye Name: 8-phenyl-5-[4-(3-pyridylmethyl)-1,4-diazepan-1-yl]-2-(trifluoromethyl)-1,6-naphthyridine CAS Name: 8-phenyl-5-[4-(3-pyridinylmethyl)-1,4-diazepan-1-yl]-2-(trifluoromethyl)-1,6-naphthyridine IUPAC Name: 8-phenyl-5-[4-(pyridin-3-ylmethyl)-1,4-diazepan-1-yl]-2-(trifluoromethyl)-1,6-naphthyridine Traditional Name: 8-phenyl-5-[4-(3-pyridylmethyl)-1,4-diazepan-1-yl]-2-(trifluoromethyl)-1,6-naphthyridine Formula: C26H24F3N5 MolecularWeight: 463.49747

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)C2=NC=C(C3=C2C=CC(=N3)C(F)(F)F)C4=CC=CC=C4)CC5=CN=CC=C5

Isomeric SMILES

C1CN(CCN(C1)C2=NC=C(C3=C2C=CC(=N3)C(F)(F)F)C4=CC=CC=C4)CC5=CN=CC=C5

InChI

InChI=1S/C26H24F3N5/c27-26(28,29)23-10-9-21-24(32-23)22(20-7-2-1-3-8-20)17-31-25(21)34-13-5-12-33(14-15-34)18-19-6-4-11-30-16-19/h1-4,6-11,16-17H,5,12-15,18H2