6-(cyclohexylmethoxy)-N-[4-[2-(dibutylamino)ethylsulfonyl]phenyl]-7H-purin-2-amine

Systemtic Name: 6-(cyclohexylmethoxy)-N-[4-[2-(dibutylamino)ethylsulfonyl]phenyl]-7H-purin-2-amine Openeye Name: 6-(cyclohexylmethoxy)-N-[4-[2-(dibutylamino)ethylsulfonyl]phenyl]-7H-purin-2-amine CAS Name: 6-(cyclohexylmethoxy)-N-[4-[2-(dibutylamino)ethylsulfonyl]phenyl]-7H-purin-2-amine IUPAC Name: 6-(cyclohexylmethoxy)-N-[4-[2-(dibutylamino)ethylsulfonyl]phenyl]-7H-purin-2-amine Traditional Name: dibutyl-[2-[4-[[6-(cyclohexylmethoxy)-7H-purin-2-yl]amino]phenyl]sulfonylethyl]amine Formula: C28H42N6O3S MolecularWeight: 542.73648

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCCC)CCS(=O)(=O)C1=CC=C(C=C1)NC2=NC3=C(C(=N2)OCC4CCCCC4)NC=N3

Isomeric SMILES

CCCCN(CCCC)CCS(=O)(=O)C1=CC=C(C=C1)NC2=NC3=C(C(=N2)OCC4CCCCC4)NC=N3

InChI

InChI=1S/C28H42N6O3S/c1-3-5-16-34(17-6-4-2)18-19-38(35,36)24-14-12-23(13-15-24)31-28-32-26-25(29-21-30-26)27(33-28)37-20-22-10-8-7-9-11-22/h12-15,21-22H,3-11,16-20H2,1-2H3,(H2,29,30,31,32,33)