2-[3,7-dimethyl-2,6-bis(oxidanylidene)purin-1-yl]-N-(3-phenylmethoxypropyl)ethanamide

Systemtic Name: 2-[3,7-dimethyl-2,6-bis(oxidanylidene)purin-1-yl]-N-(3-phenylmethoxypropyl)ethanamide Openeye Name: N-(3-benzyloxypropyl)-2-(3,7-dimethyl-2,6-dioxo-purin-1-yl)acetamide CAS Name: 2-(3,7-dimethyl-2,6-dioxo-1-purinyl)-N-(3-phenylmethoxypropyl)acetamide IUPAC Name: 2-(3,7-dimethyl-2,6-dioxopurin-1-yl)-N-(3-phenylmethoxypropyl)acetamide Traditional Name: N-(3-benzoxypropyl)-2-(2,6-diketo-3,7-dimethyl-purin-1-yl)acetamide Formula: C19H23N5O4 MolecularWeight: 385.41702

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC2=C1C(=O)N(C(=O)N2C)CC(=O)NCCCOCC3=CC=CC=C3

Isomeric SMILES

CN1C=NC2=C1C(=O)N(C(=O)N2C)CC(=O)NCCCOCC3=CC=CC=C3

InChI

InChI=1S/C19H23N5O4/c1-22-13-21-17-16(22)18(26)24(19(27)23(17)2)11-15(25)20-9-6-10-28-12-14-7-4-3-5-8-14/h3-5,7-8,13H,6,9-12H2,1-2H3,(H,20,25)