(6E)-2-azanyl-6-[3-[(2-fluoranyl-4-methyl-phenyl)-methyl-amino]-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene]-N-piperidin-4-yl-1H-pyridine-3-carboxamide

Systemtic Name: (6E)-2-azanyl-6-[3-[(2-fluoranyl-4-methyl-phenyl)-methyl-amino]-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene]-N-piperidin-4-yl-1H-pyridine-3-carboxamide Openeye Name: (6E)-2-amino-6-[3-(2-fluoro-N,4-dimethyl-anilino)-6-oxo-cyclohexa-2,4-dien-1-ylidene]-N-(4-piperidyl)-1H-pyridine-3-carboxamide CAS Name: (6E)-2-amino-6-[3-(2-fluoro-N,4-dimethylanilino)-6-oxo-1-cyclohexa-2,4-dienylidene]-N-(4-piperidinyl)-1H-pyridine-3-carboxamide IUPAC Name: (6E)-2-amino-6-[3-(2-fluoro-N,4-dimethylanilino)-6-oxocyclohexa-2,4-dien-1-ylidene]-N-piperidin-4-yl-1H-pyridine-3-carboxamide Traditional Name: (6E)-2-amino-6-[3-(2-fluoro-N,4-dimethyl-anilino)-6-keto-cyclohexa-2,4-dien-1-ylidene]-N-(4-piperidyl)-1H-pyridine-3-carboxamide Formula: C25H28FN5O2 MolecularWeight: 449.520523

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)N(C)C2=CC(=C3C=CC(=C(N3)N)C(=O)NC4CCNCC4)C(=O)C=C2)F

Isomeric SMILES

CC1=CC(=C(C=C1)N(C)C2=C/C(=C\3/C=CC(=C(N3)N)C(=O)NC4CCNCC4)/C(=O)C=C2)F

InChI

InChI=1S/C25H28FN5O2/c1-15-3-7-22(20(26)13-15)31(2)17-4-8-23(32)19(14-17)21-6-5-18(24(27)30-21)25(33)29-16-9-11-28-12-10-16/h3-8,13-14,16,28,30H,9-12,27H2,1-2H3,(H,29,33)/b21-19+