2-[[[2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-2-oxidanylidene-ethyl]-methyl-amino]methyl]-1H-quinazolin-4-one

Systemtic Name: 2-[[[2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-2-oxidanylidene-ethyl]-methyl-amino]methyl]-1H-quinazolin-4-one Openeye Name: 2-[[[2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-2-oxo-ethyl]-methyl-amino]methyl]-1H-quinazolin-4-one CAS Name: 2-[[[2-[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-2-oxoethyl]-methylamino]methyl]-1H-quinazolin-4-one IUPAC Name: 2-[[[2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-2-oxoethyl]-methylamino]methyl]-1H-quinazolin-4-one Traditional Name: 2-[[[2-keto-2-(4-piperonylpiperazino)ethyl]-methyl-amino]methyl]-1H-quinazolin-4-one Formula: C24H27N5O4 MolecularWeight: 449.50228

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=NC(=O)C2=CC=CC=C2N1)CC(=O)N3CCN(CC3)CC4=CC5=C(C=C4)OCO5

Isomeric SMILES

CN(CC1=NC(=O)C2=CC=CC=C2N1)CC(=O)N3CCN(CC3)CC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C24H27N5O4/c1-27(14-22-25-19-5-3-2-4-18(19)24(31)26-22)15-23(30)29-10-8-28(9-11-29)13-17-6-7-20-21(12-17)33-16-32-20/h2-7,12H,8-11,13-16H2,1H3,(H,25,26,31)