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

Systemtic Name: 6-(2-azanyl-5-phenyl-1H-pyrimidin-6-ylidene)-3-[(3,4-dichlorophenyl)methoxy]cyclohexa-2,4-dien-1-one Openeye Name: 6-(2-amino-5-phenyl-1H-pyrimidin-6-ylidene)-3-[(3,4-dichlorophenyl)methoxy]cyclohexa-2,4-dien-1-one CAS Name: 6-(2-amino-5-phenyl-1H-pyrimidin-6-ylidene)-3-[(3,4-dichlorophenyl)methoxy]-1-cyclohexa-2,4-dienone IUPAC Name: 6-(2-amino-5-phenyl-1H-pyrimidin-6-ylidene)-3-[(3,4-dichlorophenyl)methoxy]cyclohexa-2,4-dien-1-one Traditional Name: 6-(2-amino-5-phenyl-1H-pyrimidin-6-ylidene)-3-(3,4-dichlorobenzyl)oxy-cyclohexa-2,4-dien-1-one Formula: C23H17Cl2N3O2 MolecularWeight: 438.30598

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CN=C(NC2=C3C=CC(=CC3=O)OCC4=CC(=C(C=C4)Cl)Cl)N

Isomeric SMILES

C1=CC=C(C=C1)C2=CN=C(NC2=C3C=CC(=CC3=O)OCC4=CC(=C(C=C4)Cl)Cl)N

InChI

InChI=1S/C23H17Cl2N3O2/c24-19-9-6-14(10-20(19)25)13-30-16-7-8-17(21(29)11-16)22-18(12-27-23(26)28-22)15-4-2-1-3-5-15/h1-12H,13H2,(H3,26,27,28)