(6Z)-6-[[(4-fluorophenyl)methylamino]-oxidanyl-methylidene]-2-[(3-imidazol-1-ylpropylamino)-phenyl-methyl]-1H-pyrimidine-4,5-dione

Systemtic Name: (6Z)-6-[[(4-fluorophenyl)methylamino]-oxidanyl-methylidene]-2-[(3-imidazol-1-ylpropylamino)-phenyl-methyl]-1H-pyrimidine-4,5-dione Openeye Name: (6Z)-6-[[(4-fluorophenyl)methylamino]-hydroxy-methylene]-2-[(3-imidazol-1-ylpropylamino)-phenyl-methyl]-1H-pyrimidine-4,5-dione CAS Name: (6Z)-6-[[(4-fluorophenyl)methylamino]-hydroxymethylidene]-2-[[3-(1-imidazolyl)propylamino]-phenylmethyl]-1H-pyrimidine-4,5-dione IUPAC Name: (6Z)-6-[[(4-fluorophenyl)methylamino]-hydroxymethylidene]-2-[(3-imidazol-1-ylpropylamino)-phenylmethyl]-1H-pyrimidine-4,5-dione Traditional Name: (6Z)-6-[[(4-fluorobenzyl)amino]-hydroxy-methylene]-2-[(3-imidazol-1-ylpropylamino)-phenyl-methyl]-1H-pyrimidine-4,5-quinone Formula: C25H25FN6O3 MolecularWeight: 476.502803

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C2=NC(=O)C(=O)C(=C(NCC3=CC=C(C=C3)F)O)N2)NCCCN4C=CN=C4

Isomeric SMILES

C1=CC=C(C=C1)C(C2=NC(=O)C(=O)/C(=C(\NCC3=CC=C(C=C3)F)/O)/N2)NCCCN4C=CN=C4

InChI

InChI=1S/C25H25FN6O3/c26-19-9-7-17(8-10-19)15-29-24(34)21-22(33)25(35)31-23(30-21)20(18-5-2-1-3-6-18)28-11-4-13-32-14-12-27-16-32/h1-3,5-10,12,14,16,20,28-29,34H,4,11,13,15H2,(H,30,31,35)/b24-21-