1-[4-(4-chlorophenyl)-2-[(4-methylquinazolin-2-yl)amino]pyrimidin-5-yl]ethanone

Systemtic Name: 1-[4-(4-chlorophenyl)-2-[(4-methylquinazolin-2-yl)amino]pyrimidin-5-yl]ethanone Openeye Name: 1-[4-(4-chlorophenyl)-2-[(4-methylquinazolin-2-yl)amino]pyrimidin-5-yl]ethanone CAS Name: 1-[4-(4-chlorophenyl)-2-[(4-methyl-2-quinazolinyl)amino]-5-pyrimidinyl]ethanone IUPAC Name: 1-[4-(4-chlorophenyl)-2-[(4-methylquinazolin-2-yl)amino]pyrimidin-5-yl]ethanone Traditional Name: 1-[4-(4-chlorophenyl)-2-[(4-methylquinazolin-2-yl)amino]pyrimidin-5-yl]ethanone Formula: C21H16ClN5O MolecularWeight: 389.83764

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC2=CC=CC=C12)NC3=NC=C(C(=N3)C4=CC=C(C=C4)Cl)C(=O)C

Isomeric SMILES

CC1=NC(=NC2=CC=CC=C12)NC3=NC=C(C(=N3)C4=CC=C(C=C4)Cl)C(=O)C

InChI

InChI=1S/C21H16ClN5O/c1-12-16-5-3-4-6-18(16)25-21(24-12)27-20-23-11-17(13(2)28)19(26-20)14-7-9-15(22)10-8-14/h3-11H,1-2H3,(H,23,24,25,26,27)