(7E)-7-[5-[[3,4-bis(fluoranyl)phenyl]methyl]-1,2-dihydro-1,2,4-triazol-3-ylidene]-5-[1,1-bis(oxidanylidene)-1,2-thiazinan-2-yl]-1,6-naphthyridin-8-one

Systemtic Name: (7E)-7-[5-[[3,4-bis(fluoranyl)phenyl]methyl]-1,2-dihydro-1,2,4-triazol-3-ylidene]-5-[1,1-bis(oxidanylidene)-1,2-thiazinan-2-yl]-1,6-naphthyridin-8-one Openeye Name: (7E)-7-[5-[(3,4-difluorophenyl)methyl]-1,2-dihydro-1,2,4-triazol-3-ylidene]-5-(1,1-dioxothiazinan-2-yl)-1,6-naphthyridin-8-one CAS Name: (7E)-7-[5-[(3,4-difluorophenyl)methyl]-1,2-dihydro-1,2,4-triazol-3-ylidene]-5-(1,1-dioxo-2-thiazinanyl)-1,6-naphthyridin-8-one IUPAC Name: (7E)-7-[5-[(3,4-difluorophenyl)methyl]-1,2-dihydro-1,2,4-triazol-3-ylidene]-5-(1,1-dioxothiazinan-2-yl)-1,6-naphthyridin-8-one Traditional Name: (7E)-7-[5-(3,4-difluorobenzyl)-1,2-dihydro-1,2,4-triazol-3-ylidene]-5-(1,1-diketothiazinan-2-yl)-1,6-naphthyridin-8-one Formula: C21H18F2N6O3S MolecularWeight: 472.467826

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Descriptors Computed from Structure

Canonical SMILES:

C1CCS(=O)(=O)N(C1)C2=NC(=C3NNC(=N3)CC4=CC(=C(C=C4)F)F)C(=O)C5=C2C=CC=N5

Isomeric SMILES

C1CCS(=O)(=O)N(C1)C2=N/C(=C\3/NNC(=N3)CC4=CC(=C(C=C4)F)F)/C(=O)C5=C2C=CC=N5

InChI

InChI=1S/C21H18F2N6O3S/c22-14-6-5-12(10-15(14)23)11-16-25-20(28-27-16)18-19(30)17-13(4-3-7-24-17)21(26-18)29-8-1-2-9-33(29,31)32/h3-7,10,28H,1-2,8-9,11H2,(H,25,27)/b20-18+