6-(5-bromanyl-2-methyl-phenyl)-N4-(4-nitrophenyl)pyrimidine-2,4-diamine

Systemtic Name: 6-(5-bromanyl-2-methyl-phenyl)-N4-(4-nitrophenyl)pyrimidine-2,4-diamine Openeye Name: 6-(5-bromo-2-methyl-phenyl)-N4-(4-nitrophenyl)pyrimidine-2,4-diamine CAS Name: 6-(5-bromo-2-methylphenyl)-N4-(4-nitrophenyl)pyrimidine-2,4-diamine IUPAC Name: 6-(5-bromo-2-methylphenyl)-4-N-(4-nitrophenyl)pyrimidine-2,4-diamine Traditional Name: [2-amino-6-(5-bromo-2-methyl-phenyl)pyrimidin-4-yl]-(4-nitrophenyl)amine Formula: C17H14BrN5O2 MolecularWeight: 400.22936

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Br)C2=CC(=NC(=N2)N)NC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)Br)C2=CC(=NC(=N2)N)NC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H14BrN5O2/c1-10-2-3-11(18)8-14(10)15-9-16(22-17(19)21-15)20-12-4-6-13(7-5-12)23(24)25/h2-9H,1H3,(H3,19,20,21,22)