N6-(3-chloranyl-4-fluoranyl-phenyl)-N4-(2-methylphenyl)pyrimidine-4,6-diamine

Systemtic Name: N6-(3-chloranyl-4-fluoranyl-phenyl)-N4-(2-methylphenyl)pyrimidine-4,6-diamine Openeye Name: N6-(3-chloro-4-fluoro-phenyl)-N4-(o-tolyl)pyrimidine-4,6-diamine CAS Name: N6-(3-chloro-4-fluorophenyl)-N4-(2-methylphenyl)pyrimidine-4,6-diamine IUPAC Name: 6-N-(3-chloro-4-fluorophenyl)-4-N-(2-methylphenyl)pyrimidine-4,6-diamine Traditional Name: [6-(3-chloro-4-fluoro-anilino)pyrimidin-4-yl]-(o-tolyl)amine Formula: C17H14ClFN4 MolecularWeight: 328.771263

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC2=NC=NC(=C2)NC3=CC(=C(C=C3)F)Cl

Isomeric SMILES

CC1=CC=CC=C1NC2=NC=NC(=C2)NC3=CC(=C(C=C3)F)Cl

InChI

InChI=1S/C17H14ClFN4/c1-11-4-2-3-5-15(11)23-17-9-16(20-10-21-17)22-12-6-7-14(19)13(18)8-12/h2-10H,1H3,(H2,20,21,22,23)