N-(2,6-dimethylphenyl)-4-[[6-(4-methylpiperazin-1-yl)-4-phenyl-quinazolin-2-yl]amino]benzamide

Systemtic Name: N-(2,6-dimethylphenyl)-4-[[6-(4-methylpiperazin-1-yl)-4-phenyl-quinazolin-2-yl]amino]benzamide Openeye Name: N-(2,6-dimethylphenyl)-4-[[6-(4-methylpiperazin-1-yl)-4-phenyl-quinazolin-2-yl]amino]benzamide CAS Name: N-(2,6-dimethylphenyl)-4-[[6-(4-methyl-1-piperazinyl)-4-phenyl-2-quinazolinyl]amino]benzamide IUPAC Name: N-(2,6-dimethylphenyl)-4-[[6-(4-methylpiperazin-1-yl)-4-phenylquinazolin-2-yl]amino]benzamide Traditional Name: N-(2,6-dimethylphenyl)-4-[[6-(4-methylpiperazino)-4-phenyl-quinazolin-2-yl]amino]benzamide Formula: C34H34N6O MolecularWeight: 542.67336

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(=O)C2=CC=C(C=C2)NC3=NC4=C(C=C(C=C4)N5CCN(CC5)C)C(=N3)C6=CC=CC=C6

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=O)C2=CC=C(C=C2)NC3=NC4=C(C=C(C=C4)N5CCN(CC5)C)C(=N3)C6=CC=CC=C6

InChI

InChI=1S/C34H34N6O/c1-23-8-7-9-24(2)31(23)37-33(41)26-12-14-27(15-13-26)35-34-36-30-17-16-28(40-20-18-39(3)19-21-40)22-29(30)32(38-34)25-10-5-4-6-11-25/h4-17,22H,18-21H2,1-3H3,(H,37,41)(H,35,36,38)