3,5-bis(chloranyl)-4-[4-[3-(methoxymethoxy)phenyl]-5-(2-methylsulfanylpyrimidin-4-yl)-3-oxidanyl-1H-imidazol-2-ylidene]cyclohexa-2,5-dien-1-one

Systemtic Name: 3,5-bis(chloranyl)-4-[4-[3-(methoxymethoxy)phenyl]-5-(2-methylsulfanylpyrimidin-4-yl)-3-oxidanyl-1H-imidazol-2-ylidene]cyclohexa-2,5-dien-1-one Openeye Name: 3,5-dichloro-4-[3-hydroxy-4-[3-(methoxymethoxy)phenyl]-5-(2-methylsulfanylpyrimidin-4-yl)-1H-imidazol-2-ylidene]cyclohexa-2,5-dien-1-one CAS Name: 3,5-dichloro-4-[3-hydroxy-4-[3-(methoxymethoxy)phenyl]-5-[2-(methylthio)-4-pyrimidinyl]-1H-imidazol-2-ylidene]-1-cyclohexa-2,5-dienone IUPAC Name: 3,5-dichloro-4-[3-hydroxy-4-[3-(methoxymethoxy)phenyl]-5-(2-methylsulfanylpyrimidin-4-yl)-1H-imidazol-2-ylidene]cyclohexa-2,5-dien-1-one Traditional Name: 3,5-dichloro-4-[1-hydroxy-5-[3-(methoxymethoxy)phenyl]-4-[2-(methylthio)pyrimidin-4-yl]-4-imidazolin-2-ylidene]cyclohexa-2,5-dien-1-one Formula: C22H18Cl2N4O4S MolecularWeight: 505.37372

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COCOC1=CC=CC(=C1)C2=C(NC(=C3C(=CC(=O)C=C3Cl)Cl)N2O)C4=NC(=NC=C4)SC

Isomeric SMILES

COCOC1=CC=CC(=C1)C2=C(NC(=C3C(=CC(=O)C=C3Cl)Cl)N2O)C4=NC(=NC=C4)SC

InChI

InChI=1S/C22H18Cl2N4O4S/c1-31-11-32-14-5-3-4-12(8-14)20-19(17-6-7-25-22(26-17)33-2)27-21(28(20)30)18-15(23)9-13(29)10-16(18)24/h3-10,27,30H,11H2,1-2H3