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

Systemtic Name: 5-nitro-N4-phenyl-N4-(phenylmethyl)pyrimidine-4,6-diamine Openeye Name: N4-benzyl-5-nitro-N4-phenyl-pyrimidine-4,6-diamine CAS Name: 5-nitro-N4-phenyl-N4-(phenylmethyl)pyrimidine-4,6-diamine IUPAC Name: 4-N-benzyl-5-nitro-4-N-phenylpyrimidine-4,6-diamine Traditional Name: (6-amino-5-nitro-pyrimidin-4-yl)-benzyl-phenyl-amine Formula: C17H15N5O2 MolecularWeight: 321.3333

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H15N5O2/c18-16-15(22(23)24)17(20-12-19-16)21(14-9-5-2-6-10-14)11-13-7-3-1-4-8-13/h1-10,12H,11H2,(H2,18,19,20)