4-[[6-(cyclohexylmethoxy)-7H-purin-2-yl]amino]-N-cyclopropyl-benzenesulfonamide

Systemtic Name: 4-[[6-(cyclohexylmethoxy)-7H-purin-2-yl]amino]-N-cyclopropyl-benzenesulfonamide Openeye Name: 4-[[6-(cyclohexylmethoxy)-7H-purin-2-yl]amino]-N-cyclopropyl-benzenesulfonamide CAS Name: 4-[[6-(cyclohexylmethoxy)-7H-purin-2-yl]amino]-N-cyclopropylbenzenesulfonamide IUPAC Name: 4-[[6-(cyclohexylmethoxy)-7H-purin-2-yl]amino]-N-cyclopropylbenzenesulfonamide Traditional Name: 4-[[6-(cyclohexylmethoxy)-7H-purin-2-yl]amino]-N-cyclopropyl-benzenesulfonamide Formula: C21H26N6O3S MolecularWeight: 442.53454

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)COC2=NC(=NC3=C2NC=N3)NC4=CC=C(C=C4)S(=O)(=O)NC5CC5

Isomeric SMILES

C1CCC(CC1)COC2=NC(=NC3=C2NC=N3)NC4=CC=C(C=C4)S(=O)(=O)NC5CC5

InChI

InChI=1S/C21H26N6O3S/c28-31(29,27-16-6-7-16)17-10-8-15(9-11-17)24-21-25-19-18(22-13-23-19)20(26-21)30-12-14-4-2-1-3-5-14/h8-11,13-14,16,27H,1-7,12H2,(H2,22,23,24,25,26)