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

Systemtic Name: (6Z)-6-[[(4-fluorophenyl)methylamino]-oxidanyl-methylidene]-2-[phenyl-(2-pyrrolidin-1-ylethylamino)methyl]-1H-pyrimidine-4,5-dione Openeye Name: (6Z)-6-[[(4-fluorophenyl)methylamino]-hydroxy-methylene]-2-[phenyl-(2-pyrrolidin-1-ylethylamino)methyl]-1H-pyrimidine-4,5-dione CAS Name: (6Z)-6-[[(4-fluorophenyl)methylamino]-hydroxymethylidene]-2-[phenyl-[2-(1-pyrrolidinyl)ethylamino]methyl]-1H-pyrimidine-4,5-dione IUPAC Name: (6Z)-6-[[(4-fluorophenyl)methylamino]-hydroxymethylidene]-2-[phenyl-(2-pyrrolidin-1-ylethylamino)methyl]-1H-pyrimidine-4,5-dione Traditional Name: (6Z)-6-[[(4-fluorobenzyl)amino]-hydroxy-methylene]-2-[phenyl-(2-pyrrolidinoethylamino)methyl]-1H-pyrimidine-4,5-quinone Formula: C25H28FN5O3 MolecularWeight: 465.519923

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CCNC(C2=CC=CC=C2)C3=NC(=O)C(=O)C(=C(NCC4=CC=C(C=C4)F)O)N3

Isomeric SMILES

C1CCN(C1)CCNC(C2=CC=CC=C2)C3=NC(=O)C(=O)/C(=C(\NCC4=CC=C(C=C4)F)/O)/N3

InChI

InChI=1S/C25H28FN5O3/c26-19-10-8-17(9-11-19)16-28-24(33)21-22(32)25(34)30-23(29-21)20(18-6-2-1-3-7-18)27-12-15-31-13-4-5-14-31/h1-3,6-11,20,27-28,33H,4-5,12-16H2,(H,29,30,34)/b24-21-