(1S,2R)-2-[[9-ethyl-6-[[4-(2-methylpropylsulfamoyl)phenyl]amino]purin-2-yl]amino]cyclohexane-1-carboxamide

Systemtic Name: (1S,2R)-2-[[9-ethyl-6-[[4-(2-methylpropylsulfamoyl)phenyl]amino]purin-2-yl]amino]cyclohexane-1-carboxamide Openeye Name: (1S,2R)-2-[[9-ethyl-6-[4-(isobutylsulfamoyl)anilino]purin-2-yl]amino]cyclohexanecarboxamide CAS Name: (1S,2R)-2-[[9-ethyl-6-[4-(2-methylpropylsulfamoyl)anilino]-2-purinyl]amino]-1-cyclohexanecarboxamide IUPAC Name: (1S,2R)-2-[[9-ethyl-6-[4-(2-methylpropylsulfamoyl)anilino]purin-2-yl]amino]cyclohexane-1-carboxamide Traditional Name: (1S,2R)-2-[[9-ethyl-6-[4-(isobutylsulfamoyl)anilino]purin-2-yl]amino]cyclohexanecarboxamide Formula: C24H34N8O3S MolecularWeight: 514.64356

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=NC2=C1N=C(N=C2NC3=CC=C(C=C3)S(=O)(=O)NCC(C)C)NC4CCCCC4C(=O)N

Isomeric SMILES

CCN1C=NC2=C1N=C(N=C2NC3=CC=C(C=C3)S(=O)(=O)NCC(C)C)N[C@@H]4CCCC[C@@H]4C(=O)N

InChI

InChI=1S/C24H34N8O3S/c1-4-32-14-26-20-22(28-16-9-11-17(12-10-16)36(34,35)27-13-15(2)3)30-24(31-23(20)32)29-19-8-6-5-7-18(19)21(25)33/h9-12,14-15,18-19,27H,4-8,13H2,1-3H3,(H2,25,33)(H2,28,29,30,31)/t18-,19+/m0/s1