ethyl 6-[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]sulfonylpyridine-3-carboxylate

Systemtic Name: ethyl 6-[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]sulfonylpyridine-3-carboxylate Openeye Name: ethyl 6-[[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]pyridine-3-carboxylate CAS Name: 6-[[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]-3-pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 6-[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]sulfonylpyridine-3-carboxylate Traditional Name: 6-[[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]nicotinic acid ethyl ester Formula: C30H26F2N6O7S MolecularWeight: 652.625246

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C(C=C1)S(=O)(=O)C2=C(C(=NC(=C2F)OC3=CC(=C(N)N)C=CC3=O)OC4=CC=CC(=C4)C5NC=CN5C)F

Isomeric SMILES

CCOC(=O)C1=CN=C(C=C1)S(=O)(=O)C2=C(C(=NC(=C2F)OC3=CC(=C(N)N)C=CC3=O)OC4=CC=CC(=C4)C5NC=CN5C)F

InChI

InChI=1S/C30H26F2N6O7S/c1-3-43-30(40)18-8-10-22(36-15-18)46(41,42)25-23(31)28(44-19-6-4-5-17(13-19)27-35-11-12-38(27)2)37-29(24(25)32)45-21-14-16(26(33)34)7-9-20(21)39/h4-15,27,35H,3,33-34H2,1-2H3