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

Systemtic Name: N-[3-(2-cyanopropan-2-yl)phenyl]-4-methyl-3-[(3-methyl-4-oxidanylidene-quinazolin-6-yl)amino]benzamide Openeye Name: N-[3-(1-cyano-1-methyl-ethyl)phenyl]-4-methyl-3-[(3-methyl-4-oxo-quinazolin-6-yl)amino]benzamide CAS Name: N-[3-(2-cyanopropan-2-yl)phenyl]-4-methyl-3-[(3-methyl-4-oxo-6-quinazolinyl)amino]benzamide IUPAC Name: N-[3-(2-cyanopropan-2-yl)phenyl]-4-methyl-3-[(3-methyl-4-oxoquinazolin-6-yl)amino]benzamide Traditional Name: N-[3-(1-cyano-1-methyl-ethyl)phenyl]-3-[(4-keto-3-methyl-quinazolin-6-yl)amino]-4-methyl-benzamide Formula: C27H25N5O2 MolecularWeight: 451.5197

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC2=CC=CC(=C2)C(C)(C)C#N)NC3=CC4=C(C=C3)N=CN(C4=O)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC2=CC=CC(=C2)C(C)(C)C#N)NC3=CC4=C(C=C3)N=CN(C4=O)C

InChI

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