4-[[6-(cyclohexylmethoxy)-7H-purin-2-yl]amino]-N-propyl-benzamide

Systemtic Name: 4-[[6-(cyclohexylmethoxy)-7H-purin-2-yl]amino]-N-propyl-benzamide Openeye Name: 4-[[6-(cyclohexylmethoxy)-7H-purin-2-yl]amino]-N-propyl-benzamide CAS Name: 4-[[6-(cyclohexylmethoxy)-7H-purin-2-yl]amino]-N-propylbenzamide IUPAC Name: 4-[[6-(cyclohexylmethoxy)-7H-purin-2-yl]amino]-N-propylbenzamide Traditional Name: 4-[[6-(cyclohexylmethoxy)-7H-purin-2-yl]amino]-N-propyl-benzamide Formula: C22H28N6O2 MolecularWeight: 408.49672

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C1=CC=C(C=C1)NC2=NC3=C(C(=N2)OCC4CCCCC4)NC=N3

Isomeric SMILES

CCCNC(=O)C1=CC=C(C=C1)NC2=NC3=C(C(=N2)OCC4CCCCC4)NC=N3

InChI

InChI=1S/C22H28N6O2/c1-2-12-23-20(29)16-8-10-17(11-9-16)26-22-27-19-18(24-14-25-19)21(28-22)30-13-15-6-4-3-5-7-15/h8-11,14-15H,2-7,12-13H2,1H3,(H,23,29)(H2,24,25,26,27,28)