2-methyl-5-nitro-N4,N6-diphenyl-pyrimidine-4,6-diamine

Systemtic Name: 2-methyl-5-nitro-N4,N6-diphenyl-pyrimidine-4,6-diamine Openeye Name: 2-methyl-5-nitro-N4,N6-diphenyl-pyrimidine-4,6-diamine CAS Name: 2-methyl-5-nitro-N4,N6-diphenylpyrimidine-4,6-diamine IUPAC Name: 2-methyl-5-nitro-4-N,6-N-diphenylpyrimidine-4,6-diamine Traditional Name: (6-anilino-2-methyl-5-nitro-pyrimidin-4-yl)-phenyl-amine Formula: C17H15N5O2 MolecularWeight: 321.3333

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C(=N1)NC2=CC=CC=C2)[N+](=O)[O-])NC3=CC=CC=C3

Isomeric SMILES

CC1=NC(=C(C(=N1)NC2=CC=CC=C2)[N+](=O)[O-])NC3=CC=CC=C3

InChI

InChI=1S/C17H15N5O2/c1-12-18-16(20-13-8-4-2-5-9-13)15(22(23)24)17(19-12)21-14-10-6-3-7-11-14/h2-11H,1H3,(H2,18,19,20,21)