N4-methyl-5-nitro-N4-phenyl-N6-(phenylmethyl)pyrimidine-4,6-diamine

Systemtic Name: N4-methyl-5-nitro-N4-phenyl-N6-(phenylmethyl)pyrimidine-4,6-diamine Openeye Name: N6-benzyl-N4-methyl-5-nitro-N4-phenyl-pyrimidine-4,6-diamine CAS Name: N4-methyl-5-nitro-N4-phenyl-N6-(phenylmethyl)pyrimidine-4,6-diamine IUPAC Name: 6-N-benzyl-4-N-methyl-5-nitro-4-N-phenylpyrimidine-4,6-diamine Traditional Name: [6-(benzylamino)-5-nitro-pyrimidin-4-yl]-methyl-phenyl-amine Formula: C18H17N5O2 MolecularWeight: 335.35988

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=CC=C1)C2=NC=NC(=C2[N+](=O)[O-])NCC3=CC=CC=C3

Isomeric SMILES

CN(C1=CC=CC=C1)C2=NC=NC(=C2[N+](=O)[O-])NCC3=CC=CC=C3

InChI

InChI=1S/C18H17N5O2/c1-22(15-10-6-3-7-11-15)18-16(23(24)25)17(20-13-21-18)19-12-14-8-4-2-5-9-14/h2-11,13H,12H2,1H3,(H,19,20,21)