4-[[2-phenyl-8-(thiomorpholin-4-ylmethyl)-7H-purin-6-yl]amino]cyclohexan-1-ol

Systemtic Name: 4-[[2-phenyl-8-(thiomorpholin-4-ylmethyl)-7H-purin-6-yl]amino]cyclohexan-1-ol Openeye Name: 4-[[2-phenyl-8-(thiomorpholinomethyl)-7H-purin-6-yl]amino]cyclohexanol CAS Name: 4-[[2-phenyl-8-(thiomorpholin-4-ylmethyl)-7H-purin-6-yl]amino]-1-cyclohexanol IUPAC Name: 4-[[2-phenyl-8-(thiomorpholin-4-ylmethyl)-7H-purin-6-yl]amino]cyclohexan-1-ol Traditional Name: 4-[[2-phenyl-8-(thiomorpholinomethyl)-7H-purin-6-yl]amino]cyclohexanol Formula: C22H28N6OS MolecularWeight: 424.56232

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1NC2=NC(=NC3=C2NC(=N3)CN4CCSCC4)C5=CC=CC=C5)O

Isomeric SMILES

C1CC(CCC1NC2=NC(=NC3=C2NC(=N3)CN4CCSCC4)C5=CC=CC=C5)O

InChI

InChI=1S/C22H28N6OS/c29-17-8-6-16(7-9-17)23-21-19-22(27-20(26-21)15-4-2-1-3-5-15)25-18(24-19)14-28-10-12-30-13-11-28/h1-5,16-17,29H,6-14H2,(H2,23,24,25,26,27)