4-chloranyl-N-(3-fluoranyl-5-morpholin-4-yl-phenyl)-3-[2-methyl-6-(4-methylpiperazin-1-yl)-4-oxidanylidene-quinazolin-3-yl]benzamide

Systemtic Name: 4-chloranyl-N-(3-fluoranyl-5-morpholin-4-yl-phenyl)-3-[2-methyl-6-(4-methylpiperazin-1-yl)-4-oxidanylidene-quinazolin-3-yl]benzamide Openeye Name: 4-chloro-N-(3-fluoro-5-morpholino-phenyl)-3-[2-methyl-6-(4-methylpiperazin-1-yl)-4-oxo-quinazolin-3-yl]benzamide CAS Name: 4-chloro-N-[3-fluoro-5-(4-morpholinyl)phenyl]-3-[2-methyl-6-(4-methyl-1-piperazinyl)-4-oxo-3-quinazolinyl]benzamide IUPAC Name: 4-chloro-N-(3-fluoro-5-morpholin-4-ylphenyl)-3-[2-methyl-6-(4-methylpiperazin-1-yl)-4-oxoquinazolin-3-yl]benzamide Traditional Name: 4-chloro-N-(3-fluoro-5-morpholino-phenyl)-3-[4-keto-2-methyl-6-(4-methylpiperazino)quinazolin-3-yl]benzamide Formula: C31H32ClFN6O3 MolecularWeight: 591.075583

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=C(C=C2)N3CCN(CC3)C)C(=O)N1C4=C(C=CC(=C4)C(=O)NC5=CC(=CC(=C5)N6CCOCC6)F)Cl

Isomeric SMILES

CC1=NC2=C(C=C(C=C2)N3CCN(CC3)C)C(=O)N1C4=C(C=CC(=C4)C(=O)NC5=CC(=CC(=C5)N6CCOCC6)F)Cl

InChI

InChI=1S/C31H32ClFN6O3/c1-20-34-28-6-4-24(37-9-7-36(2)8-10-37)19-26(28)31(41)39(20)29-15-21(3-5-27(29)32)30(40)35-23-16-22(33)17-25(18-23)38-11-13-42-14-12-38/h3-6,15-19H,7-14H2,1-2H3,(H,35,40)