2-[1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]-N-[(3-methoxy-4-propoxy-phenyl)methyl]-N-propyl-ethanamide

Systemtic Name: 2-[1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]-N-[(3-methoxy-4-propoxy-phenyl)methyl]-N-propyl-ethanamide Openeye Name: 2-(1,3-dimethyl-2,6-dioxo-purin-7-yl)-N-[(3-methoxy-4-propoxy-phenyl)methyl]-N-propyl-acetamide CAS Name: 2-(1,3-dimethyl-2,6-dioxo-7-purinyl)-N-[(3-methoxy-4-propoxyphenyl)methyl]-N-propylacetamide IUPAC Name: 2-(1,3-dimethyl-2,6-dioxopurin-7-yl)-N-[(3-methoxy-4-propoxyphenyl)methyl]-N-propylacetamide Traditional Name: 2-(2,6-diketo-1,3-dimethyl-purin-7-yl)-N-(3-methoxy-4-propoxy-benzyl)-N-propyl-acetamide Formula: C23H31N5O5 MolecularWeight: 457.52274

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CC1=CC(=C(C=C1)OCCC)OC)C(=O)CN2C=NC3=C2C(=O)N(C(=O)N3C)C

Isomeric SMILES

CCCN(CC1=CC(=C(C=C1)OCCC)OC)C(=O)CN2C=NC3=C2C(=O)N(C(=O)N3C)C

InChI

InChI=1S/C23H31N5O5/c1-6-10-27(13-16-8-9-17(33-11-7-2)18(12-16)32-5)19(29)14-28-15-24-21-20(28)22(30)26(4)23(31)25(21)3/h8-9,12,15H,6-7,10-11,13-14H2,1-5H3