N'-[3-(6-azanyl-2-butoxy-8-oxidanylidene-7H-purin-9-yl)propyl]-N,N-dimethyl-N'-(phenylmethyl)butanediamide

Systemtic Name: N'-[3-(6-azanyl-2-butoxy-8-oxidanylidene-7H-purin-9-yl)propyl]-N,N-dimethyl-N'-(phenylmethyl)butanediamide Openeye Name: N'-[3-(6-amino-2-butoxy-8-oxo-7H-purin-9-yl)propyl]-N'-benzyl-N,N-dimethyl-butanediamide CAS Name: N'-[3-(6-amino-2-butoxy-8-oxo-7H-purin-9-yl)propyl]-N,N-dimethyl-N'-(phenylmethyl)butanediamide IUPAC Name: N'-[3-(6-amino-2-butoxy-8-oxo-7H-purin-9-yl)propyl]-N'-benzyl-N,N-dimethylbutanediamide Traditional Name: N'-[3-(6-amino-2-butoxy-8-keto-7H-purin-9-yl)propyl]-N'-benzyl-N,N-dimethyl-succinamide Formula: C25H35N7O4 MolecularWeight: 497.5899

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=NC2=C(C(=N1)N)NC(=O)N2CCCN(CC3=CC=CC=C3)C(=O)CCC(=O)N(C)C

Isomeric SMILES

CCCCOC1=NC2=C(C(=N1)N)NC(=O)N2CCCN(CC3=CC=CC=C3)C(=O)CCC(=O)N(C)C

InChI

InChI=1S/C25H35N7O4/c1-4-5-16-36-24-28-22(26)21-23(29-24)32(25(35)27-21)15-9-14-31(17-18-10-7-6-8-11-18)20(34)13-12-19(33)30(2)3/h6-8,10-11H,4-5,9,12-17H2,1-3H3,(H,27,35)(H2,26,28,29)