5-fluoranyl-N2-[(1-phenethylsulfonylpiperidin-4-yl)methyl]pyrimidine-2,4-diamine

Systemtic Name: 5-fluoranyl-N2-[(1-phenethylsulfonylpiperidin-4-yl)methyl]pyrimidine-2,4-diamine Openeye Name: 5-fluoro-N2-[(1-phenethylsulfonyl-4-piperidyl)methyl]pyrimidine-2,4-diamine CAS Name: 5-fluoro-N2-[(1-phenethylsulfonyl-4-piperidinyl)methyl]pyrimidine-2,4-diamine IUPAC Name: 5-fluoro-2-N-[(1-phenethylsulfonylpiperidin-4-yl)methyl]pyrimidine-2,4-diamine Traditional Name: (4-amino-5-fluoro-pyrimidin-2-yl)-[(1-phenethylsulfonyl-4-piperidyl)methyl]amine Formula: C18H24FN5O2S MolecularWeight: 393.478863

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CNC2=NC=C(C(=N2)N)F)S(=O)(=O)CCC3=CC=CC=C3

Isomeric SMILES

C1CN(CCC1CNC2=NC=C(C(=N2)N)F)S(=O)(=O)CCC3=CC=CC=C3

InChI

InChI=1S/C18H24FN5O2S/c19-16-13-22-18(23-17(16)20)21-12-15-6-9-24(10-7-15)27(25,26)11-8-14-4-2-1-3-5-14/h1-5,13,15H,6-12H2,(H3,20,21,22,23)