2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-7-(2-fluorophenyl)-7,8-dihydro-6H-quinazolin-5-one

Systemtic Name: 2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-7-(2-fluorophenyl)-7,8-dihydro-6H-quinazolin-5-one Openeye Name: 2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-7-(2-fluorophenyl)-7,8-dihydro-6H-quinazolin-5-one CAS Name: 2-[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-7-(2-fluorophenyl)-7,8-dihydro-6H-quinazolin-5-one IUPAC Name: 2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-7-(2-fluorophenyl)-7,8-dihydro-6H-quinazolin-5-one Traditional Name: 7-(2-fluorophenyl)-2-(4-piperonylpiperazino)-7,8-dihydro-6H-quinazolin-5-one Formula: C26H25FN4O3 MolecularWeight: 460.500103

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC3=C(C=C2)OCO3)C4=NC=C5C(=N4)CC(CC5=O)C6=CC=CC=C6F

Isomeric SMILES

C1CN(CCN1CC2=CC3=C(C=C2)OCO3)C4=NC=C5C(=N4)CC(CC5=O)C6=CC=CC=C6F

InChI

InChI=1S/C26H25FN4O3/c27-21-4-2-1-3-19(21)18-12-22-20(23(32)13-18)14-28-26(29-22)31-9-7-30(8-10-31)15-17-5-6-24-25(11-17)34-16-33-24/h1-6,11,14,18H,7-10,12-13,15-16H2