N-(3-fluorophenyl)-2-[4-[4-(2-methyl-4-oxidanylidene-quinazolin-3-yl)phenyl]carbonylpiperazin-1-yl]ethanamide

Systemtic Name: N-(3-fluorophenyl)-2-[4-[4-(2-methyl-4-oxidanylidene-quinazolin-3-yl)phenyl]carbonylpiperazin-1-yl]ethanamide Openeye Name: N-(3-fluorophenyl)-2-[4-[4-(2-methyl-4-oxo-quinazolin-3-yl)benzoyl]piperazin-1-yl]acetamide CAS Name: N-(3-fluorophenyl)-2-[4-[[4-(2-methyl-4-oxo-3-quinazolinyl)phenyl]-oxomethyl]-1-piperazinyl]acetamide IUPAC Name: N-(3-fluorophenyl)-2-[4-[4-(2-methyl-4-oxoquinazolin-3-yl)benzoyl]piperazin-1-yl]acetamide Traditional Name: N-(3-fluorophenyl)-2-[4-[4-(4-keto-2-methyl-quinazolin-3-yl)benzoyl]piperazino]acetamide Formula: C28H26FN5O3 MolecularWeight: 499.536143

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=O)N1C3=CC=C(C=C3)C(=O)N4CCN(CC4)CC(=O)NC5=CC(=CC=C5)F

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=O)N1C3=CC=C(C=C3)C(=O)N4CCN(CC4)CC(=O)NC5=CC(=CC=C5)F

InChI

InChI=1S/C28H26FN5O3/c1-19-30-25-8-3-2-7-24(25)28(37)34(19)23-11-9-20(10-12-23)27(36)33-15-13-32(14-16-33)18-26(35)31-22-6-4-5-21(29)17-22/h2-12,17H,13-16,18H2,1H3,(H,31,35)