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

Systemtic Name: 2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-4-(methylamino)-7,8-dihydro-6H-quinazolin-5-one Openeye Name: 2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-4-(methylamino)-7,8-dihydro-6H-quinazolin-5-one CAS Name: 2-[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-4-(methylamino)-7,8-dihydro-6H-quinazolin-5-one IUPAC Name: 2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-4-(methylamino)-7,8-dihydro-6H-quinazolin-5-one Traditional Name: 4-(methylamino)-2-(4-piperonylpiperazino)-7,8-dihydro-6H-quinazolin-5-one Formula: C21H25N5O3 MolecularWeight: 395.4549

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=NC(=NC2=C1C(=O)CCC2)N3CCN(CC3)CC4=CC5=C(C=C4)OCO5

Isomeric SMILES

CNC1=NC(=NC2=C1C(=O)CCC2)N3CCN(CC3)CC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C21H25N5O3/c1-22-20-19-15(3-2-4-16(19)27)23-21(24-20)26-9-7-25(8-10-26)12-14-5-6-17-18(11-14)29-13-28-17/h5-6,11H,2-4,7-10,12-13H2,1H3,(H,22,23,24)