3-(2-methylbut-3-yn-2-yl)-N-[4-methyl-3-[(3-methyl-4-oxidanylidene-quinazolin-6-yl)amino]phenyl]benzamide

Systemtic Name: 3-(2-methylbut-3-yn-2-yl)-N-[4-methyl-3-[(3-methyl-4-oxidanylidene-quinazolin-6-yl)amino]phenyl]benzamide Openeye Name: 3-(1,1-dimethylprop-2-ynyl)-N-[4-methyl-3-[(3-methyl-4-oxo-quinazolin-6-yl)amino]phenyl]benzamide CAS Name: 3-(2-methylbut-3-yn-2-yl)-N-[4-methyl-3-[(3-methyl-4-oxo-6-quinazolinyl)amino]phenyl]benzamide IUPAC Name: 3-(2-methylbut-3-yn-2-yl)-N-[4-methyl-3-[(3-methyl-4-oxoquinazolin-6-yl)amino]phenyl]benzamide Traditional Name: 3-(1,1-dimethylprop-2-ynyl)-N-[3-[(4-keto-3-methyl-quinazolin-6-yl)amino]-4-methyl-phenyl]benzamide Formula: C28H26N4O2 MolecularWeight: 450.53164

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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#C)NC3=CC4=C(C=C3)N=CN(C4=O)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2=CC(=CC=C2)C(C)(C)C#C)NC3=CC4=C(C=C3)N=CN(C4=O)C

InChI

InChI=1S/C28H26N4O2/c1-6-28(3,4)20-9-7-8-19(14-20)26(33)31-22-11-10-18(2)25(16-22)30-21-12-13-24-23(15-21)27(34)32(5)17-29-24/h1,7-17,30H,2-5H3,(H,31,33)