3,5-bis(chloranyl)-4-[4-[2-(2-hydroxyethylamino)pyrimidin-4-yl]-5-(3-iodanylphenyl)-1,3-dihydroimidazol-2-ylidene]cyclohexa-2,5-dien-1-one

Systemtic Name: 3,5-bis(chloranyl)-4-[4-[2-(2-hydroxyethylamino)pyrimidin-4-yl]-5-(3-iodanylphenyl)-1,3-dihydroimidazol-2-ylidene]cyclohexa-2,5-dien-1-one Openeye Name: 3,5-dichloro-4-[4-[2-(2-hydroxyethylamino)pyrimidin-4-yl]-5-(3-iodophenyl)-1,3-dihydroimidazol-2-ylidene]cyclohexa-2,5-dien-1-one CAS Name: 3,5-dichloro-4-[4-[2-(2-hydroxyethylamino)-4-pyrimidinyl]-5-(3-iodophenyl)-1,3-dihydroimidazol-2-ylidene]-1-cyclohexa-2,5-dienone IUPAC Name: 3,5-dichloro-4-[4-[2-(2-hydroxyethylamino)pyrimidin-4-yl]-5-(3-iodophenyl)-1,3-dihydroimidazol-2-ylidene]cyclohexa-2,5-dien-1-one Traditional Name: 3,5-dichloro-4-[4-[2-(2-hydroxyethylamino)pyrimidin-4-yl]-5-(3-iodophenyl)-4-imidazolin-2-ylidene]cyclohexa-2,5-dien-1-one Formula: C21H16Cl2IN5O2 MolecularWeight: 568.19451

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)I)C2=C(NC(=C3C(=CC(=O)C=C3Cl)Cl)N2)C4=NC(=NC=C4)NCCO

Isomeric SMILES

C1=CC(=CC(=C1)I)C2=C(NC(=C3C(=CC(=O)C=C3Cl)Cl)N2)C4=NC(=NC=C4)NCCO

InChI

InChI=1S/C21H16Cl2IN5O2/c22-14-9-13(31)10-15(23)17(14)20-28-18(11-2-1-3-12(24)8-11)19(29-20)16-4-5-25-21(27-16)26-6-7-30/h1-5,8-10,28-30H,6-7H2,(H,25,26,27)