N2-(4-fluorophenyl)-6-[(5-pyrrolidin-1-ylsulfonylpyridin-2-yl)sulfanylmethyl]-1,3,5-triazine-2,4-diamine

Systemtic Name: N2-(4-fluorophenyl)-6-[(5-pyrrolidin-1-ylsulfonylpyridin-2-yl)sulfanylmethyl]-1,3,5-triazine-2,4-diamine Openeye Name: N2-(4-fluorophenyl)-6-[(5-pyrrolidin-1-ylsulfonyl-2-pyridyl)sulfanylmethyl]-1,3,5-triazine-2,4-diamine CAS Name: N2-(4-fluorophenyl)-6-[[[5-(1-pyrrolidinylsulfonyl)-2-pyridinyl]thio]methyl]-1,3,5-triazine-2,4-diamine IUPAC Name: 2-N-(4-fluorophenyl)-6-[(5-pyrrolidin-1-ylsulfonylpyridin-2-yl)sulfanylmethyl]-1,3,5-triazine-2,4-diamine Traditional Name: [4-amino-6-[[(5-pyrrolidinosulfonyl-2-pyridyl)thio]methyl]-s-triazin-2-yl]-(4-fluorophenyl)amine Formula: C19H20FN7O2S2 MolecularWeight: 461.536203

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CN=C(C=C2)SCC3=NC(=NC(=N3)NC4=CC=C(C=C4)F)N

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CN=C(C=C2)SCC3=NC(=NC(=N3)NC4=CC=C(C=C4)F)N

InChI

InChI=1S/C19H20FN7O2S2/c20-13-3-5-14(6-4-13)23-19-25-16(24-18(21)26-19)12-30-17-8-7-15(11-22-17)31(28,29)27-9-1-2-10-27/h3-8,11H,1-2,9-10,12H2,(H3,21,23,24,25,26)