N-(3-chlorophenyl)-4-[[6-(cyclohexylmethoxy)-7H-purin-2-yl]amino]benzenesulfonamide

Systemtic Name: N-(3-chlorophenyl)-4-[[6-(cyclohexylmethoxy)-7H-purin-2-yl]amino]benzenesulfonamide Openeye Name: N-(3-chlorophenyl)-4-[[6-(cyclohexylmethoxy)-7H-purin-2-yl]amino]benzenesulfonamide CAS Name: N-(3-chlorophenyl)-4-[[6-(cyclohexylmethoxy)-7H-purin-2-yl]amino]benzenesulfonamide IUPAC Name: N-(3-chlorophenyl)-4-[[6-(cyclohexylmethoxy)-7H-purin-2-yl]amino]benzenesulfonamide Traditional Name: N-(3-chlorophenyl)-4-[[6-(cyclohexylmethoxy)-7H-purin-2-yl]amino]benzenesulfonamide Formula: C24H25ClN6O3S MolecularWeight: 513.0117

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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)NC5=CC(=CC=C5)Cl

Isomeric SMILES

C1CCC(CC1)COC2=NC(=NC3=C2NC=N3)NC4=CC=C(C=C4)S(=O)(=O)NC5=CC(=CC=C5)Cl

InChI

InChI=1S/C24H25ClN6O3S/c25-17-7-4-8-19(13-17)31-35(32,33)20-11-9-18(10-12-20)28-24-29-22-21(26-15-27-22)23(30-24)34-14-16-5-2-1-3-6-16/h4,7-13,15-16,31H,1-3,5-6,14H2,(H2,26,27,28,29,30)