5-fluoranyl-N2-[phenethylsulfonyl(piperidin-4-yl)methyl]pyrimidine-2,4-diamine

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

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC1C(NC2=NC=C(C(=N2)N)F)S(=O)(=O)CCC3=CC=CC=C3

Isomeric SMILES

C1CNCCC1C(NC2=NC=C(C(=N2)N)F)S(=O)(=O)CCC3=CC=CC=C3

InChI

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