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

Systemtic Name: 6-[2-azanyl-5-(2-bromanylphenoxy)-1H-pyrimidin-6-ylidene]-3-[(3-chlorophenyl)methoxy]cyclohexa-2,4-dien-1-one Openeye Name: 6-[2-amino-5-(2-bromophenoxy)-1H-pyrimidin-6-ylidene]-3-[(3-chlorophenyl)methoxy]cyclohexa-2,4-dien-1-one CAS Name: 6-[2-amino-5-(2-bromophenoxy)-1H-pyrimidin-6-ylidene]-3-[(3-chlorophenyl)methoxy]-1-cyclohexa-2,4-dienone IUPAC Name: 6-[2-amino-5-(2-bromophenoxy)-1H-pyrimidin-6-ylidene]-3-[(3-chlorophenyl)methoxy]cyclohexa-2,4-dien-1-one Traditional Name: 6-[2-amino-5-(2-bromophenoxy)-1H-pyrimidin-6-ylidene]-3-(3-chlorobenzyl)oxy-cyclohexa-2,4-dien-1-one Formula: C23H17BrClN3O3 MolecularWeight: 498.75638

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)OC2=CN=C(NC2=C3C=CC(=CC3=O)OCC4=CC(=CC=C4)Cl)N)Br

Isomeric SMILES

C1=CC=C(C(=C1)OC2=CN=C(NC2=C3C=CC(=CC3=O)OCC4=CC(=CC=C4)Cl)N)Br

InChI

InChI=1S/C23H17BrClN3O3/c24-18-6-1-2-7-20(18)31-21-12-27-23(26)28-22(21)17-9-8-16(11-19(17)29)30-13-14-4-3-5-15(25)10-14/h1-12H,13H2,(H3,26,27,28)