2-(4-aminophenyl)-1-[2-(4-butoxy-4-phenyl-piperidin-1-yl)ethyl]-2,3-dihydroquinazolin-4-one

Systemtic Name: 2-(4-aminophenyl)-1-[2-(4-butoxy-4-phenyl-piperidin-1-yl)ethyl]-2,3-dihydroquinazolin-4-one Openeye Name: 2-(4-aminophenyl)-1-[2-(4-butoxy-4-phenyl-1-piperidyl)ethyl]-2,3-dihydroquinazolin-4-one CAS Name: 2-(4-aminophenyl)-1-[2-(4-butoxy-4-phenyl-1-piperidinyl)ethyl]-2,3-dihydroquinazolin-4-one IUPAC Name: 2-(4-aminophenyl)-1-[2-(4-butoxy-4-phenylpiperidin-1-yl)ethyl]-2,3-dihydroquinazolin-4-one Traditional Name: 2-(4-aminophenyl)-1-[2-(4-butoxy-4-phenyl-piperidino)ethyl]-2,3-dihydroquinazolin-4-one Formula: C31H38N4O2 MolecularWeight: 498.65902

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1(CCN(CC1)CCN2C(NC(=O)C3=CC=CC=C32)C4=CC=C(C=C4)N)C5=CC=CC=C5

Isomeric SMILES

CCCCOC1(CCN(CC1)CCN2C(NC(=O)C3=CC=CC=C32)C4=CC=C(C=C4)N)C5=CC=CC=C5

InChI

InChI=1S/C31H38N4O2/c1-2-3-23-37-31(25-9-5-4-6-10-25)17-19-34(20-18-31)21-22-35-28-12-8-7-11-27(28)30(36)33-29(35)24-13-15-26(32)16-14-24/h4-16,29H,2-3,17-23,32H2,1H3,(H,33,36)