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

Systemtic Name: N2-(4-chlorophenyl)-6-[(5-piperidin-1-ylsulfonylpyridin-2-yl)sulfanylmethyl]-1,3,5-triazine-2,4-diamine Openeye Name: N2-(4-chlorophenyl)-6-[[5-(1-piperidylsulfonyl)-2-pyridyl]sulfanylmethyl]-1,3,5-triazine-2,4-diamine CAS Name: N2-(4-chlorophenyl)-6-[[[5-(1-piperidinylsulfonyl)-2-pyridinyl]thio]methyl]-1,3,5-triazine-2,4-diamine IUPAC Name: 2-N-(4-chlorophenyl)-6-[(5-piperidin-1-ylsulfonylpyridin-2-yl)sulfanylmethyl]-1,3,5-triazine-2,4-diamine Traditional Name: [4-amino-6-[[(5-piperidinosulfonyl-2-pyridyl)thio]methyl]-s-triazin-2-yl]-(4-chlorophenyl)amine Formula: C20H22ClN7O2S2 MolecularWeight: 492.01738

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CN=C(C=C2)SCC3=NC(=NC(=N3)NC4=CC=C(C=C4)Cl)N

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CN=C(C=C2)SCC3=NC(=NC(=N3)NC4=CC=C(C=C4)Cl)N

InChI

InChI=1S/C20H22ClN7O2S2/c21-14-4-6-15(7-5-14)24-20-26-17(25-19(22)27-20)13-31-18-9-8-16(12-23-18)32(29,30)28-10-2-1-3-11-28/h4-9,12H,1-3,10-11,13H2,(H3,22,24,25,26,27)