2-[2-[3-[bis(azanyl)methylidene]-6-oxidanylidene-cyclohexa-1,4-dien-1-yl]oxy-3,5-bis(fluoranyl)-6-[3-(3-methyl-1,2-dihydroimidazol-2-yl)phenoxy]pyridin-4-yl]sulfonyl-N,N-dimethanoyl-benzamide

Systemtic Name: 2-[2-[3-[bis(azanyl)methylidene]-6-oxidanylidene-cyclohexa-1,4-dien-1-yl]oxy-3,5-bis(fluoranyl)-6-[3-(3-methyl-1,2-dihydroimidazol-2-yl)phenoxy]pyridin-4-yl]sulfonyl-N,N-dimethanoyl-benzamide Openeye Name: 2-[[2-[3-(diaminomethylene)-6-oxo-cyclohexa-1,4-dien-1-yl]oxy-3,5-difluoro-6-[3-(3-methyl-1,2-dihydroimidazol-2-yl)phenoxy]-4-pyridyl]sulfonyl]-N,N-diformyl-benzamide CAS Name: 2-[[2-[[3-(diaminomethylidene)-6-oxo-1-cyclohexa-1,4-dienyl]oxy]-3,5-difluoro-6-[3-(3-methyl-1,2-dihydroimidazol-2-yl)phenoxy]-4-pyridinyl]sulfonyl]-N,N-diformylbenzamide IUPAC Name: 2-[2-[3-(diaminomethylidene)-6-oxocyclohexa-1,4-dien-1-yl]oxy-3,5-difluoro-6-[3-(3-methyl-1,2-dihydroimidazol-2-yl)phenoxy]pyridin-4-yl]sulfonyl-N,N-diformylbenzamide Traditional Name: 2-[[2-[3-(diaminomethylene)-6-keto-cyclohexa-1,4-dien-1-yl]oxy-3,5-difluoro-6-[3-(1-methyl-4-imidazolin-2-yl)phenoxy]-4-pyridyl]sulfonyl]-N,N-diformyl-benzamide Formula: C31H24F2N6O8S MolecularWeight: 678.619466

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C=CNC1C2=CC(=CC=C2)OC3=NC(=C(C(=C3F)S(=O)(=O)C4=CC=CC=C4C(=O)N(C=O)C=O)F)OC5=CC(=C(N)N)C=CC5=O

Isomeric SMILES

CN1C=CNC1C2=CC(=CC=C2)OC3=NC(=C(C(=C3F)S(=O)(=O)C4=CC=CC=C4C(=O)N(C=O)C=O)F)OC5=CC(=C(N)N)C=CC5=O

InChI

InChI=1S/C31H24F2N6O8S/c1-38-12-11-36-28(38)18-5-4-6-19(13-18)46-29-24(32)26(25(33)30(37-29)47-22-14-17(27(34)35)9-10-21(22)42)48(44,45)23-8-3-2-7-20(23)31(43)39(15-40)16-41/h2-16,28,36H,34-35H2,1H3