3-[[6-(cyclohexylmethoxy)-7H-purin-2-yl]amino]-N-(2-hydroxyethyl)benzamide

Systemtic Name: 3-[[6-(cyclohexylmethoxy)-7H-purin-2-yl]amino]-N-(2-hydroxyethyl)benzamide Openeye Name: 3-[[6-(cyclohexylmethoxy)-7H-purin-2-yl]amino]-N-(2-hydroxyethyl)benzamide CAS Name: 3-[[6-(cyclohexylmethoxy)-7H-purin-2-yl]amino]-N-(2-hydroxyethyl)benzamide IUPAC Name: 3-[[6-(cyclohexylmethoxy)-7H-purin-2-yl]amino]-N-(2-hydroxyethyl)benzamide Traditional Name: 3-[[6-(cyclohexylmethoxy)-7H-purin-2-yl]amino]-N-(2-hydroxyethyl)benzamide Formula: C21H26N6O3 MolecularWeight: 410.46954

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)COC2=NC(=NC3=C2NC=N3)NC4=CC=CC(=C4)C(=O)NCCO

Isomeric SMILES

C1CCC(CC1)COC2=NC(=NC3=C2NC=N3)NC4=CC=CC(=C4)C(=O)NCCO

InChI

InChI=1S/C21H26N6O3/c28-10-9-22-19(29)15-7-4-8-16(11-15)25-21-26-18-17(23-13-24-18)20(27-21)30-12-14-5-2-1-3-6-14/h4,7-8,11,13-14,28H,1-3,5-6,9-10,12H2,(H,22,29)(H2,23,24,25,26,27)