6-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-N4-methyl-N4-(phenylmethyl)pyrimidine-4,5-diamine

Systemtic Name: 6-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-N4-methyl-N4-(phenylmethyl)pyrimidine-4,5-diamine Openeye Name: 6-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-N4-benzyl-N4-methyl-pyrimidine-4,5-diamine CAS Name: 6-[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-N4-methyl-N4-(phenylmethyl)pyrimidine-4,5-diamine IUPAC Name: 6-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-4-N-benzyl-4-N-methylpyrimidine-4,5-diamine Traditional Name: [5-amino-6-(4-piperonylpiperazino)pyrimidin-4-yl]-benzyl-methyl-amine Formula: C24H28N6O2 MolecularWeight: 432.51812

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CC=C1)C2=NC=NC(=C2N)N3CCN(CC3)CC4=CC5=C(C=C4)OCO5

Isomeric SMILES

CN(CC1=CC=CC=C1)C2=NC=NC(=C2N)N3CCN(CC3)CC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C24H28N6O2/c1-28(14-18-5-3-2-4-6-18)23-22(25)24(27-16-26-23)30-11-9-29(10-12-30)15-19-7-8-20-21(13-19)32-17-31-20/h2-8,13,16H,9-12,14-15,17,25H2,1H3