N-[(3-chlorophenyl)methyl]-5-[2-(4-ethanoylpiperazin-2-yl)ethoxy]-6-fluoranyl-4-oxidanylidene-1H-quinazoline-2-carboxamide

Systemtic Name: N-[(3-chlorophenyl)methyl]-5-[2-(4-ethanoylpiperazin-2-yl)ethoxy]-6-fluoranyl-4-oxidanylidene-1H-quinazoline-2-carboxamide Openeye Name: 5-[2-(4-acetylpiperazin-2-yl)ethoxy]-N-[(3-chlorophenyl)methyl]-6-fluoro-4-oxo-1H-quinazoline-2-carboxamide CAS Name: 5-[2-(4-acetyl-2-piperazinyl)ethoxy]-N-[(3-chlorophenyl)methyl]-6-fluoro-4-oxo-1H-quinazoline-2-carboxamide IUPAC Name: 5-[2-(4-acetylpiperazin-2-yl)ethoxy]-N-[(3-chlorophenyl)methyl]-6-fluoro-4-oxo-1H-quinazoline-2-carboxamide Traditional Name: 5-[2-(4-acetylpiperazin-2-yl)ethoxy]-N-(3-chlorobenzyl)-6-fluoro-4-keto-1H-quinazoline-2-carboxamide Formula: C24H25ClFN5O4 MolecularWeight: 501.937803

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCNC(C1)CCOC2=C(C=CC3=C2C(=O)N=C(N3)C(=O)NCC4=CC(=CC=C4)Cl)F

Isomeric SMILES

CC(=O)N1CCNC(C1)CCOC2=C(C=CC3=C2C(=O)N=C(N3)C(=O)NCC4=CC(=CC=C4)Cl)F

InChI

InChI=1S/C24H25ClFN5O4/c1-14(32)31-9-8-27-17(13-31)7-10-35-21-18(26)5-6-19-20(21)23(33)30-22(29-19)24(34)28-12-15-3-2-4-16(25)11-15/h2-6,11,17,27H,7-10,12-13H2,1H3,(H,28,34)(H,29,30,33)