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

Systemtic Name: 6-[4-(diphenylmethyl)piperazin-1-yl]-N-methyl-5-nitro-N-(phenylmethyl)pyrimidin-4-amine Openeye Name: 6-(4-benzhydrylpiperazin-1-yl)-N-benzyl-N-methyl-5-nitro-pyrimidin-4-amine CAS Name: 6-[4-(diphenylmethyl)-1-piperazinyl]-N-methyl-5-nitro-N-(phenylmethyl)-4-pyrimidinamine IUPAC Name: 6-(4-benzhydrylpiperazin-1-yl)-N-benzyl-N-methyl-5-nitropyrimidin-4-amine Traditional Name: [6-(4-benzhydrylpiperazino)-5-nitro-pyrimidin-4-yl]-benzyl-methyl-amine Formula: C29H30N6O2 MolecularWeight: 494.5875

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CC=C1)C2=NC=NC(=C2[N+](=O)[O-])N3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CN(CC1=CC=CC=C1)C2=NC=NC(=C2[N+](=O)[O-])N3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C29H30N6O2/c1-32(21-23-11-5-2-6-12-23)28-27(35(36)37)29(31-22-30-28)34-19-17-33(18-20-34)26(24-13-7-3-8-14-24)25-15-9-4-10-16-25/h2-16,22,26H,17-21H2,1H3