3-(3-chloranyl-4-fluoranyl-phenyl)-1-[2-(4-ethanoylpiperazin-1-yl)-2-oxidanylidene-ethyl]quinazoline-2,4-dione

Systemtic Name: 3-(3-chloranyl-4-fluoranyl-phenyl)-1-[2-(4-ethanoylpiperazin-1-yl)-2-oxidanylidene-ethyl]quinazoline-2,4-dione Openeye Name: 1-[2-(4-acetylpiperazin-1-yl)-2-oxo-ethyl]-3-(3-chloro-4-fluoro-phenyl)quinazoline-2,4-dione CAS Name: 1-[2-(4-acetyl-1-piperazinyl)-2-oxoethyl]-3-(3-chloro-4-fluorophenyl)quinazoline-2,4-dione IUPAC Name: 1-[2-(4-acetylpiperazin-1-yl)-2-oxoethyl]-3-(3-chloro-4-fluorophenyl)quinazoline-2,4-dione Traditional Name: 1-[2-(4-acetylpiperazino)-2-keto-ethyl]-3-(3-chloro-4-fluoro-phenyl)quinazoline-2,4-quinone Formula: C22H20ClFN4O4 MolecularWeight: 458.870003

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)C(=O)CN2C3=CC=CC=C3C(=O)N(C2=O)C4=CC(=C(C=C4)F)Cl

Isomeric SMILES

CC(=O)N1CCN(CC1)C(=O)CN2C3=CC=CC=C3C(=O)N(C2=O)C4=CC(=C(C=C4)F)Cl

InChI

InChI=1S/C22H20ClFN4O4/c1-14(29)25-8-10-26(11-9-25)20(30)13-27-19-5-3-2-4-16(19)21(31)28(22(27)32)15-6-7-18(24)17(23)12-15/h2-7,12H,8-11,13H2,1H3