6-[[6-(cyclohexylmethoxy)-7H-purin-2-yl]amino]-N-methyl-pyridine-3-sulfonamide

Systemtic Name: 6-[[6-(cyclohexylmethoxy)-7H-purin-2-yl]amino]-N-methyl-pyridine-3-sulfonamide Openeye Name: 6-[[6-(cyclohexylmethoxy)-7H-purin-2-yl]amino]-N-methyl-pyridine-3-sulfonamide CAS Name: 6-[[6-(cyclohexylmethoxy)-7H-purin-2-yl]amino]-N-methyl-3-pyridinesulfonamide IUPAC Name: 6-[[6-(cyclohexylmethoxy)-7H-purin-2-yl]amino]-N-methylpyridine-3-sulfonamide Traditional Name: 6-[[6-(cyclohexylmethoxy)-7H-purin-2-yl]amino]-N-methyl-pyridine-3-sulfonamide Formula: C18H23N7O3S MolecularWeight: 417.48532

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Descriptors Computed from Structure

Canonical SMILES:

CNS(=O)(=O)C1=CN=C(C=C1)NC2=NC3=C(C(=N2)OCC4CCCCC4)NC=N3

Isomeric SMILES

CNS(=O)(=O)C1=CN=C(C=C1)NC2=NC3=C(C(=N2)OCC4CCCCC4)NC=N3

InChI

InChI=1S/C18H23N7O3S/c1-19-29(26,27)13-7-8-14(20-9-13)23-18-24-16-15(21-11-22-16)17(25-18)28-10-12-5-3-2-4-6-12/h7-9,11-12,19H,2-6,10H2,1H3,(H2,20,21,22,23,24,25)