3-(2-cyanopropan-2-yl)-N-[3-[(7-methoxyquinazolin-4-yl)amino]-4-methyl-phenyl]benzamide

Systemtic Name: 3-(2-cyanopropan-2-yl)-N-[3-[(7-methoxyquinazolin-4-yl)amino]-4-methyl-phenyl]benzamide Openeye Name: 3-(1-cyano-1-methyl-ethyl)-N-[3-[(7-methoxyquinazolin-4-yl)amino]-4-methyl-phenyl]benzamide CAS Name: 3-(2-cyanopropan-2-yl)-N-[3-[(7-methoxy-4-quinazolinyl)amino]-4-methylphenyl]benzamide IUPAC Name: 3-(2-cyanopropan-2-yl)-N-[3-[(7-methoxyquinazolin-4-yl)amino]-4-methylphenyl]benzamide Traditional Name: 3-(1-cyano-1-methyl-ethyl)-N-[3-[(7-methoxyquinazolin-4-yl)amino]-4-methyl-phenyl]benzamide Formula: C27H25N5O2 MolecularWeight: 451.5197

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2=CC(=CC=C2)C(C)(C)C#N)NC3=NC=NC4=C3C=CC(=C4)OC

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2=CC(=CC=C2)C(C)(C)C#N)NC3=NC=NC4=C3C=CC(=C4)OC

InChI

InChI=1S/C27H25N5O2/c1-17-8-9-20(31-26(33)18-6-5-7-19(12-18)27(2,3)15-28)13-23(17)32-25-22-11-10-21(34-4)14-24(22)29-16-30-25/h5-14,16H,1-4H3,(H,31,33)(H,29,30,32)