N2,N4-bis(3-chloranyl-4-fluoranyl-phenyl)-6-methyl-5-nitro-pyrimidine-2,4-diamine

Systemtic Name: N2,N4-bis(3-chloranyl-4-fluoranyl-phenyl)-6-methyl-5-nitro-pyrimidine-2,4-diamine Openeye Name: N2,N4-bis(3-chloro-4-fluoro-phenyl)-6-methyl-5-nitro-pyrimidine-2,4-diamine CAS Name: N2,N4-bis(3-chloro-4-fluorophenyl)-6-methyl-5-nitropyrimidine-2,4-diamine IUPAC Name: 2-N,4-N-bis(3-chloro-4-fluorophenyl)-6-methyl-5-nitropyrimidine-2,4-diamine Traditional Name: [2-(3-chloro-4-fluoro-anilino)-6-methyl-5-nitro-pyrimidin-4-yl]-(3-chloro-4-fluoro-phenyl)amine Formula: C17H11Cl2F2N5O2 MolecularWeight: 426.204346

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H11Cl2F2N5O2/c1-8-15(26(27)28)16(23-9-2-4-13(20)11(18)6-9)25-17(22-8)24-10-3-5-14(21)12(19)7-10/h2-7H,1H3,(H2,22,23,24,25)