4-[1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]-N-(2-phenylpropyl)butanamide

Systemtic Name: 4-[1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]-N-(2-phenylpropyl)butanamide Openeye Name: 4-(1,3-dimethyl-2,6-dioxo-purin-7-yl)-N-(2-phenylpropyl)butanamide CAS Name: 4-(1,3-dimethyl-2,6-dioxo-7-purinyl)-N-(2-phenylpropyl)butanamide IUPAC Name: 4-(1,3-dimethyl-2,6-dioxopurin-7-yl)-N-(2-phenylpropyl)butanamide Traditional Name: 4-(2,6-diketo-1,3-dimethyl-purin-7-yl)-N-(2-phenylpropyl)butyramide Formula: C20H25N5O3 MolecularWeight: 383.4442

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Descriptors Computed from Structure

Canonical SMILES:

CC(CNC(=O)CCCN1C=NC2=C1C(=O)N(C(=O)N2C)C)C3=CC=CC=C3

Isomeric SMILES

CC(CNC(=O)CCCN1C=NC2=C1C(=O)N(C(=O)N2C)C)C3=CC=CC=C3

InChI

InChI=1S/C20H25N5O3/c1-14(15-8-5-4-6-9-15)12-21-16(26)10-7-11-25-13-22-18-17(25)19(27)24(3)20(28)23(18)2/h4-6,8-9,13-14H,7,10-12H2,1-3H3,(H,21,26)