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

Systemtic Name: 5-[2-(4-ethanoylpiperazin-2-yl)ethoxy]-6-fluoranyl-N-[(3-methoxyphenyl)methyl]-4-oxidanylidene-1H-quinazoline-2-carboxamide Openeye Name: 5-[2-(4-acetylpiperazin-2-yl)ethoxy]-6-fluoro-N-[(3-methoxyphenyl)methyl]-4-oxo-1H-quinazoline-2-carboxamide CAS Name: 5-[2-(4-acetyl-2-piperazinyl)ethoxy]-6-fluoro-N-[(3-methoxyphenyl)methyl]-4-oxo-1H-quinazoline-2-carboxamide IUPAC Name: 5-[2-(4-acetylpiperazin-2-yl)ethoxy]-6-fluoro-N-[(3-methoxyphenyl)methyl]-4-oxo-1H-quinazoline-2-carboxamide Traditional Name: 5-[2-(4-acetylpiperazin-2-yl)ethoxy]-6-fluoro-4-keto-N-m-anisyl-1H-quinazoline-2-carboxamide Formula: C25H28FN5O5 MolecularWeight: 497.518723

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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)OC)F

Isomeric SMILES

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

InChI

InChI=1S/C25H28FN5O5/c1-15(32)31-10-9-27-17(14-31)8-11-36-22-19(26)6-7-20-21(22)24(33)30-23(29-20)25(34)28-13-16-4-3-5-18(12-16)35-2/h3-7,12,17,27H,8-11,13-14H2,1-2H3,(H,28,34)(H,29,30,33)