[4-[(3-acetamidophenyl)amino]quinazolin-2-yl]methyl-dimethyl-azanium

Systemtic Name: [4-[(3-acetamidophenyl)amino]quinazolin-2-yl]methyl-dimethyl-azanium Openeye Name: [4-(3-acetamidoanilino)quinazolin-2-yl]methyl-dimethyl-ammonium CAS Name: [4-(3-acetamidoanilino)-2-quinazolinyl]methyl-dimethylammonium IUPAC Name: [4-(3-acetamidoanilino)quinazolin-2-yl]methyl-dimethylazanium Traditional Name: [4-(3-acetamidoanilino)quinazolin-2-yl]methyl-dimethyl-ammonium Formula: C19H22N5O+ MolecularWeight: 336.41088

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=CC(=C1)NC2=NC(=NC3=CC=CC=C32)C[NH+](C)C

Isomeric SMILES

CC(=O)NC1=CC=CC(=C1)NC2=NC(=NC3=CC=CC=C32)C[NH+](C)C

InChI

InChI=1S/C19H21N5O/c1-13(25)20-14-7-6-8-15(11-14)21-19-16-9-4-5-10-17(16)22-18(23-19)12-24(2)3/h4-11H,12H2,1-3H3,(H,20,25)(H,21,22,23)/p+1