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

Systemtic Name: N-butyl-2-[3,7-dimethyl-2,6-bis(oxidanylidene)purin-1-yl]-N-phenyl-ethanamide Openeye Name: N-butyl-2-(3,7-dimethyl-2,6-dioxo-purin-1-yl)-N-phenyl-acetamide CAS Name: N-butyl-2-(3,7-dimethyl-2,6-dioxo-1-purinyl)-N-phenylacetamide IUPAC Name: N-butyl-2-(3,7-dimethyl-2,6-dioxopurin-1-yl)-N-phenylacetamide Traditional Name: N-butyl-2-(2,6-diketo-3,7-dimethyl-purin-1-yl)-N-phenyl-acetamide Formula: C19H23N5O3 MolecularWeight: 369.41762

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C1=CC=CC=C1)C(=O)CN2C(=O)C3=C(N=CN3C)N(C2=O)C

Isomeric SMILES

CCCCN(C1=CC=CC=C1)C(=O)CN2C(=O)C3=C(N=CN3C)N(C2=O)C

InChI

InChI=1S/C19H23N5O3/c1-4-5-11-23(14-9-7-6-8-10-14)15(25)12-24-18(26)16-17(20-13-21(16)2)22(3)19(24)27/h6-10,13H,4-5,11-12H2,1-3H3