1,6-naphthyridin-2-yl-[4-[4-(trifluoromethyloxy)phenyl]sulfonyl-1,4-diazepan-1-yl]methanone

Systemtic Name: 1,6-naphthyridin-2-yl-[4-[4-(trifluoromethyloxy)phenyl]sulfonyl-1,4-diazepan-1-yl]methanone Openeye Name: 1,6-naphthyridin-2-yl-[4-[4-(trifluoromethoxy)phenyl]sulfonyl-1,4-diazepan-1-yl]methanone CAS Name: 1,6-naphthyridin-2-yl-[4-[4-(trifluoromethoxy)phenyl]sulfonyl-1,4-diazepan-1-yl]methanone IUPAC Name: 1,6-naphthyridin-2-yl-[4-[4-(trifluoromethoxy)phenyl]sulfonyl-1,4-diazepan-1-yl]methanone Traditional Name: 1,6-naphthyridin-2-yl-[4-[4-(trifluoromethoxy)phenyl]sulfonyl-1,4-diazepan-1-yl]methanone Formula: C21H19F3N4O4S MolecularWeight: 480.46017

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H19F3N4O4S/c22-21(23,24)32-16-3-5-17(6-4-16)33(30,31)28-11-1-10-27(12-13-28)20(29)19-7-2-15-14-25-9-8-18(15)26-19/h2-9,14H,1,10-13H2