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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCN(C1=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/c1-2-34(25-16-10-5-11-17-25)29-27(35(36)37)28(30-22-31-29)33-20-18-32(19-21-33)26(23-12-6-3-7-13-23)24-14-8-4-9-15-24/h3-17,22,26H,2,18-21H2,1H3