4-fluoranyl-N-[2-methyl-3-[[6-methyl-2-(4-methylpiperazin-1-yl)quinazolin-4-yl]amino]phenyl]benzamide

Systemtic Name: 4-fluoranyl-N-[2-methyl-3-[[6-methyl-2-(4-methylpiperazin-1-yl)quinazolin-4-yl]amino]phenyl]benzamide Openeye Name: 4-fluoro-N-[2-methyl-3-[[6-methyl-2-(4-methylpiperazin-1-yl)quinazolin-4-yl]amino]phenyl]benzamide CAS Name: 4-fluoro-N-[2-methyl-3-[[6-methyl-2-(4-methyl-1-piperazinyl)-4-quinazolinyl]amino]phenyl]benzamide IUPAC Name: 4-fluoro-N-[2-methyl-3-[[6-methyl-2-(4-methylpiperazin-1-yl)quinazolin-4-yl]amino]phenyl]benzamide Traditional Name: 4-fluoro-N-[2-methyl-3-[[6-methyl-2-(4-methylpiperazino)quinazolin-4-yl]amino]phenyl]benzamide Formula: C28H29FN6O MolecularWeight: 484.567863

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(N=C2NC3=C(C(=CC=C3)NC(=O)C4=CC=C(C=C4)F)C)N5CCN(CC5)C

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(N=C2NC3=C(C(=CC=C3)NC(=O)C4=CC=C(C=C4)F)C)N5CCN(CC5)C

InChI

InChI=1S/C28H29FN6O/c1-18-7-12-25-22(17-18)26(33-28(32-25)35-15-13-34(3)14-16-35)30-23-5-4-6-24(19(23)2)31-27(36)20-8-10-21(29)11-9-20/h4-12,17H,13-16H2,1-3H3,(H,31,36)(H,30,32,33)