5-cyclopropyl-8-fluoranyl-7-(4-methylpiperazin-1-yl)-2-phenylmethoxy-pyrimido[1,6-a]benzimidazole-1,3-dione

Systemtic Name: 5-cyclopropyl-8-fluoranyl-7-(4-methylpiperazin-1-yl)-2-phenylmethoxy-pyrimido[1,6-a]benzimidazole-1,3-dione Openeye Name: 2-benzyloxy-5-cyclopropyl-8-fluoro-7-(4-methylpiperazin-1-yl)pyrimido[1,6-a]benzimidazole-1,3-dione CAS Name: 5-cyclopropyl-8-fluoro-7-(4-methyl-1-piperazinyl)-2-phenylmethoxypyrimido[1,6-a]benzimidazole-1,3-dione IUPAC Name: 5-cyclopropyl-8-fluoro-7-(4-methylpiperazin-1-yl)-2-phenylmethoxypyrimido[1,6-a]benzimidazole-1,3-dione Traditional Name: 2-benzoxy-5-cyclopropyl-8-fluoro-7-(4-methylpiperazino)pyrimido[1,6-a]benzimidazole-1,3-quinone Formula: C25H26FN5O3 MolecularWeight: 463.504043

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=C(C=C3C(=C2)N(C4=CC(=O)N(C(=O)N34)OCC5=CC=CC=C5)C6CC6)F

Isomeric SMILES

CN1CCN(CC1)C2=C(C=C3C(=C2)N(C4=CC(=O)N(C(=O)N34)OCC5=CC=CC=C5)C6CC6)F

InChI

InChI=1S/C25H26FN5O3/c1-27-9-11-28(12-10-27)20-14-22-21(13-19(20)26)30-23(29(22)18-7-8-18)15-24(32)31(25(30)33)34-16-17-5-3-2-4-6-17/h2-6,13-15,18H,7-12,16H2,1H3