N4-(2,5-dimethylphenyl)-5-nitro-N6-phenyl-pyrimidine-4,6-diamine

Systemtic Name: N4-(2,5-dimethylphenyl)-5-nitro-N6-phenyl-pyrimidine-4,6-diamine Openeye Name: N4-(2,5-dimethylphenyl)-5-nitro-N6-phenyl-pyrimidine-4,6-diamine CAS Name: N4-(2,5-dimethylphenyl)-5-nitro-N6-phenylpyrimidine-4,6-diamine IUPAC Name: 4-N-(2,5-dimethylphenyl)-5-nitro-6-N-phenylpyrimidine-4,6-diamine Traditional Name: (6-anilino-5-nitro-pyrimidin-4-yl)-(2,5-dimethylphenyl)amine Formula: C18H17N5O2 MolecularWeight: 335.35988

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)NC2=NC=NC(=C2[N+](=O)[O-])NC3=CC=CC=C3

Isomeric SMILES

CC1=CC(=C(C=C1)C)NC2=NC=NC(=C2[N+](=O)[O-])NC3=CC=CC=C3

InChI

InChI=1S/C18H17N5O2/c1-12-8-9-13(2)15(10-12)22-18-16(23(24)25)17(19-11-20-18)21-14-6-4-3-5-7-14/h3-11H,1-2H3,(H2,19,20,21,22)