N-methyl-5-nitro-N-phenethyl-6-[4-(phenylmethyl)piperazin-1-yl]pyrimidin-4-amine

Systemtic Name: N-methyl-5-nitro-N-phenethyl-6-[4-(phenylmethyl)piperazin-1-yl]pyrimidin-4-amine Openeye Name: 6-(4-benzylpiperazin-1-yl)-N-methyl-5-nitro-N-phenethyl-pyrimidin-4-amine CAS Name: N-methyl-5-nitro-N-phenethyl-6-[4-(phenylmethyl)-1-piperazinyl]-4-pyrimidinamine IUPAC Name: 6-(4-benzylpiperazin-1-yl)-N-methyl-5-nitro-N-phenethylpyrimidin-4-amine Traditional Name: [6-(4-benzylpiperazino)-5-nitro-pyrimidin-4-yl]-methyl-phenethyl-amine Formula: C24H28N6O2 MolecularWeight: 432.51812

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC1=CC=CC=C1)C2=NC=NC(=C2[N+](=O)[O-])N3CCN(CC3)CC4=CC=CC=C4

Isomeric SMILES

CN(CCC1=CC=CC=C1)C2=NC=NC(=C2[N+](=O)[O-])N3CCN(CC3)CC4=CC=CC=C4

InChI

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