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

Systemtic Name: 4-[[6-(cyclohexylmethoxy)-7H-purin-2-yl]amino]-N,N-bis(3-oxidanylpropyl)benzenesulfonamide Openeye Name: 4-[[6-(cyclohexylmethoxy)-7H-purin-2-yl]amino]-N,N-bis(3-hydroxypropyl)benzenesulfonamide CAS Name: 4-[[6-(cyclohexylmethoxy)-7H-purin-2-yl]amino]-N,N-bis(3-hydroxypropyl)benzenesulfonamide IUPAC Name: 4-[[6-(cyclohexylmethoxy)-7H-purin-2-yl]amino]-N,N-bis(3-hydroxypropyl)benzenesulfonamide Traditional Name: 4-[[6-(cyclohexylmethoxy)-7H-purin-2-yl]amino]-N,N-bis(3-hydroxypropyl)benzenesulfonamide Formula: C24H34N6O5S MolecularWeight: 518.62896

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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)N(CCCO)CCCO

Isomeric SMILES

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

InChI

InChI=1S/C24H34N6O5S/c31-14-4-12-30(13-5-15-32)36(33,34)20-10-8-19(9-11-20)27-24-28-22-21(25-17-26-22)23(29-24)35-16-18-6-2-1-3-7-18/h8-11,17-18,31-32H,1-7,12-16H2,(H2,25,26,27,28,29)