1-ethyl-3-[5-(1-ethyl-6-fluoranyl-4-oxidanylidene-7-piperazin-1-yl-quinolin-3-yl)-1,3,4-oxadiazol-2-yl]-6-fluoranyl-7-piperazin-1-yl-1,8-naphthyridin-4-one

Systemtic Name: 1-ethyl-3-[5-(1-ethyl-6-fluoranyl-4-oxidanylidene-7-piperazin-1-yl-quinolin-3-yl)-1,3,4-oxadiazol-2-yl]-6-fluoranyl-7-piperazin-1-yl-1,8-naphthyridin-4-one Openeye Name: 1-ethyl-3-[5-(1-ethyl-6-fluoro-4-oxo-7-piperazin-1-yl-3-quinolyl)-1,3,4-oxadiazol-2-yl]-6-fluoro-7-piperazin-1-yl-1,8-naphthyridin-4-one CAS Name: 1-ethyl-3-[5-[1-ethyl-6-fluoro-4-oxo-7-(1-piperazinyl)-3-quinolinyl]-1,3,4-oxadiazol-2-yl]-6-fluoro-7-(1-piperazinyl)-1,8-naphthyridin-4-one IUPAC Name: 1-ethyl-3-[5-(1-ethyl-6-fluoro-4-oxo-7-piperazin-1-ylquinolin-3-yl)-1,3,4-oxadiazol-2-yl]-6-fluoro-7-piperazin-1-yl-1,8-naphthyridin-4-one Traditional Name: 1-ethyl-3-[5-(1-ethyl-6-fluoro-4-keto-7-piperazino-3-quinolyl)-1,3,4-oxadiazol-2-yl]-6-fluoro-7-piperazino-1,8-naphthyridin-4-one Formula: C31H33F2N9O3 MolecularWeight: 617.649026

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=O)C2=CC(=C(C=C21)N3CCNCC3)F)C4=NN=C(O4)C5=CN(C6=NC(=C(C=C6C5=O)F)N7CCNCC7)CC

Isomeric SMILES

CCN1C=C(C(=O)C2=CC(=C(C=C21)N3CCNCC3)F)C4=NN=C(O4)C5=CN(C6=NC(=C(C=C6C5=O)F)N7CCNCC7)CC

InChI

InChI=1S/C31H33F2N9O3/c1-3-39-16-20(26(43)18-13-22(32)25(15-24(18)39)41-9-5-34-6-10-41)30-37-38-31(45-30)21-17-40(4-2)28-19(27(21)44)14-23(33)29(36-28)42-11-7-35-8-12-42/h13-17,34-35H,3-12H2,1-2H3