1-ethyl-6-fluoranyl-7-(4-methylpiperazin-1-yl)-3-phenylmethoxy-quinazoline-2,4-dione

Systemtic Name: 1-ethyl-6-fluoranyl-7-(4-methylpiperazin-1-yl)-3-phenylmethoxy-quinazoline-2,4-dione Openeye Name: 3-benzyloxy-1-ethyl-6-fluoro-7-(4-methylpiperazin-1-yl)quinazoline-2,4-dione CAS Name: 1-ethyl-6-fluoro-7-(4-methyl-1-piperazinyl)-3-phenylmethoxyquinazoline-2,4-dione IUPAC Name: 1-ethyl-6-fluoro-7-(4-methylpiperazin-1-yl)-3-phenylmethoxyquinazoline-2,4-dione Traditional Name: 3-benzoxy-1-ethyl-6-fluoro-7-(4-methylpiperazino)quinazoline-2,4-quinone Formula: C22H25FN4O3 MolecularWeight: 412.457303

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=CC(=C(C=C2C(=O)N(C1=O)OCC3=CC=CC=C3)F)N4CCN(CC4)C

Isomeric SMILES

CCN1C2=CC(=C(C=C2C(=O)N(C1=O)OCC3=CC=CC=C3)F)N4CCN(CC4)C

InChI

InChI=1S/C22H25FN4O3/c1-3-26-19-14-20(25-11-9-24(2)10-12-25)18(23)13-17(19)21(28)27(22(26)29)30-15-16-7-5-4-6-8-16/h4-8,13-14H,3,9-12,15H2,1-2H3