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

Systemtic Name: 2-[1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]-N-(3-methyl-1-phenyl-butyl)ethanamide Openeye Name: 2-(1,3-dimethyl-2,6-dioxo-purin-7-yl)-N-(3-methyl-1-phenyl-butyl)acetamide CAS Name: 2-(1,3-dimethyl-2,6-dioxo-7-purinyl)-N-(3-methyl-1-phenylbutyl)acetamide IUPAC Name: 2-(1,3-dimethyl-2,6-dioxopurin-7-yl)-N-(3-methyl-1-phenylbutyl)acetamide Traditional Name: 2-(2,6-diketo-1,3-dimethyl-purin-7-yl)-N-(3-methyl-1-phenyl-butyl)acetamide Formula: C20H25N5O3 MolecularWeight: 383.4442

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C1=CC=CC=C1)NC(=O)CN2C=NC3=C2C(=O)N(C(=O)N3C)C

Isomeric SMILES

CC(C)CC(C1=CC=CC=C1)NC(=O)CN2C=NC3=C2C(=O)N(C(=O)N3C)C

InChI

InChI=1S/C20H25N5O3/c1-13(2)10-15(14-8-6-5-7-9-14)22-16(26)11-25-12-21-18-17(25)19(27)24(4)20(28)23(18)3/h5-9,12-13,15H,10-11H2,1-4H3,(H,22,26)