N2-(3-chlorophenyl)-5-nitro-N4-phenyl-pyrimidine-2,4,6-triamine

Systemtic Name: N2-(3-chlorophenyl)-5-nitro-N4-phenyl-pyrimidine-2,4,6-triamine Openeye Name: N2-(3-chlorophenyl)-5-nitro-N4-phenyl-pyrimidine-2,4,6-triamine CAS Name: N2-(3-chlorophenyl)-5-nitro-N4-phenylpyrimidine-2,4,6-triamine IUPAC Name: 2-N-(3-chlorophenyl)-5-nitro-4-N-phenylpyrimidine-2,4,6-triamine Traditional Name: (4-amino-6-anilino-5-nitro-pyrimidin-2-yl)-(3-chlorophenyl)amine Formula: C16H13ClN6O2 MolecularWeight: 356.76642

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H13ClN6O2/c17-10-5-4-8-12(9-10)20-16-21-14(18)13(23(24)25)15(22-16)19-11-6-2-1-3-7-11/h1-9H,(H4,18,19,20,21,22)