1-[4-[2-(4-chlorophenyl)quinazolin-4-yl]piperazin-1-yl]-3-methyl-butan-1-one

Systemtic Name: 1-[4-[2-(4-chlorophenyl)quinazolin-4-yl]piperazin-1-yl]-3-methyl-butan-1-one Openeye Name: 1-[4-[2-(4-chlorophenyl)quinazolin-4-yl]piperazin-1-yl]-3-methyl-butan-1-one CAS Name: 1-[4-[2-(4-chlorophenyl)-4-quinazolinyl]-1-piperazinyl]-3-methyl-1-butanone IUPAC Name: 1-[4-[2-(4-chlorophenyl)quinazolin-4-yl]piperazin-1-yl]-3-methylbutan-1-one Traditional Name: 1-[4-[2-(4-chlorophenyl)quinazolin-4-yl]piperazino]-3-methyl-butan-1-one Formula: C23H25ClN4O MolecularWeight: 408.9238

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)N1CCN(CC1)C2=NC(=NC3=CC=CC=C32)C4=CC=C(C=C4)Cl

Isomeric SMILES

CC(C)CC(=O)N1CCN(CC1)C2=NC(=NC3=CC=CC=C32)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C23H25ClN4O/c1-16(2)15-21(29)27-11-13-28(14-12-27)23-19-5-3-4-6-20(19)25-22(26-23)17-7-9-18(24)10-8-17/h3-10,16H,11-15H2,1-2H3