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

Systemtic Name: N2,N4-bis(3-azanyl-4-methyl-phenyl)-5-fluoranyl-pyrimidine-2,4-diamine Openeye Name: N2,N4-bis(3-amino-4-methyl-phenyl)-5-fluoro-pyrimidine-2,4-diamine CAS Name: N2,N4-bis(3-amino-4-methylphenyl)-5-fluoropyrimidine-2,4-diamine IUPAC Name: 2-N,4-N-bis(3-amino-4-methylphenyl)-5-fluoropyrimidine-2,4-diamine Traditional Name: [2-(3-amino-4-methyl-anilino)-5-fluoro-pyrimidin-4-yl]-(3-amino-4-methyl-phenyl)amine Formula: C18H19FN6 MolecularWeight: 338.382063

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC2=NC(=NC=C2F)NC3=CC(=C(C=C3)C)N)N

Isomeric SMILES

CC1=C(C=C(C=C1)NC2=NC(=NC=C2F)NC3=CC(=C(C=C3)C)N)N

InChI

InChI=1S/C18H19FN6/c1-10-3-5-12(7-15(10)20)23-17-14(19)9-22-18(25-17)24-13-6-4-11(2)16(21)8-13/h3-9H,20-21H2,1-2H3,(H2,22,23,24,25)