6-[2-azanyl-5-(2-bromanylphenoxy)-1H-pyrimidin-6-ylidene]-3-[(2-fluorophenyl)methoxy]cyclohexa-2,4-dien-1-one

Systemtic Name: 6-[2-azanyl-5-(2-bromanylphenoxy)-1H-pyrimidin-6-ylidene]-3-[(2-fluorophenyl)methoxy]cyclohexa-2,4-dien-1-one Openeye Name: 6-[2-amino-5-(2-bromophenoxy)-1H-pyrimidin-6-ylidene]-3-[(2-fluorophenyl)methoxy]cyclohexa-2,4-dien-1-one CAS Name: 6-[2-amino-5-(2-bromophenoxy)-1H-pyrimidin-6-ylidene]-3-[(2-fluorophenyl)methoxy]-1-cyclohexa-2,4-dienone IUPAC Name: 6-[2-amino-5-(2-bromophenoxy)-1H-pyrimidin-6-ylidene]-3-[(2-fluorophenyl)methoxy]cyclohexa-2,4-dien-1-one Traditional Name: 6-[2-amino-5-(2-bromophenoxy)-1H-pyrimidin-6-ylidene]-3-(2-fluorobenzyl)oxy-cyclohexa-2,4-dien-1-one Formula: C23H17BrFN3O3 MolecularWeight: 482.301783

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)COC2=CC(=O)C(=C3C(=CN=C(N3)N)OC4=CC=CC=C4Br)C=C2)F

Isomeric SMILES

C1=CC=C(C(=C1)COC2=CC(=O)C(=C3C(=CN=C(N3)N)OC4=CC=CC=C4Br)C=C2)F

InChI

InChI=1S/C23H17BrFN3O3/c24-17-6-2-4-8-20(17)31-21-12-27-23(26)28-22(21)16-10-9-15(11-19(16)29)30-13-14-5-1-3-7-18(14)25/h1-12H,13H2,(H3,26,27,28)