1-[4-[7-chloranyl-2-(phenylmethyl)quinazolin-4-yl]piperazin-1-yl]-3-methyl-butan-1-one

Systemtic Name: 1-[4-[7-chloranyl-2-(phenylmethyl)quinazolin-4-yl]piperazin-1-yl]-3-methyl-butan-1-one Openeye Name: 1-[4-(2-benzyl-7-chloro-quinazolin-4-yl)piperazin-1-yl]-3-methyl-butan-1-one CAS Name: 1-[4-[7-chloro-2-(phenylmethyl)-4-quinazolinyl]-1-piperazinyl]-3-methyl-1-butanone IUPAC Name: 1-[4-(2-benzyl-7-chloroquinazolin-4-yl)piperazin-1-yl]-3-methylbutan-1-one Traditional Name: 1-[4-(2-benzyl-7-chloro-quinazolin-4-yl)piperazino]-3-methyl-butan-1-one Formula: C24H27ClN4O MolecularWeight: 422.95038

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)N1CCN(CC1)C2=NC(=NC3=C2C=CC(=C3)Cl)CC4=CC=CC=C4

Isomeric SMILES

CC(C)CC(=O)N1CCN(CC1)C2=NC(=NC3=C2C=CC(=C3)Cl)CC4=CC=CC=C4

InChI

InChI=1S/C24H27ClN4O/c1-17(2)14-23(30)28-10-12-29(13-11-28)24-20-9-8-19(25)16-21(20)26-22(27-24)15-18-6-4-3-5-7-18/h3-9,16-17H,10-15H2,1-2H3