3-[7-butyl-2,6-bis(oxidanylidene)-3-propyl-purin-8-yl]-N-(2,3-dimethylphenyl)propanamide

Systemtic Name: 3-[7-butyl-2,6-bis(oxidanylidene)-3-propyl-purin-8-yl]-N-(2,3-dimethylphenyl)propanamide Openeye Name: 3-(7-butyl-2,6-dioxo-3-propyl-purin-8-yl)-N-(2,3-dimethylphenyl)propanamide CAS Name: 3-(7-butyl-2,6-dioxo-3-propyl-8-purinyl)-N-(2,3-dimethylphenyl)propanamide IUPAC Name: 3-(7-butyl-2,6-dioxo-3-propylpurin-8-yl)-N-(2,3-dimethylphenyl)propanamide Traditional Name: 3-(7-butyl-2,6-diketo-3-propyl-purin-8-yl)-N-(2,3-dimethylphenyl)propionamide Formula: C23H31N5O3 MolecularWeight: 425.52394

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=NC2=C1C(=O)NC(=O)N2CCC)CCC(=O)NC3=CC=CC(=C3C)C

Isomeric SMILES

CCCCN1C(=NC2=C1C(=O)NC(=O)N2CCC)CCC(=O)NC3=CC=CC(=C3C)C

InChI

InChI=1S/C23H31N5O3/c1-5-7-14-27-18(11-12-19(29)24-17-10-8-9-15(3)16(17)4)25-21-20(27)22(30)26-23(31)28(21)13-6-2/h8-10H,5-7,11-14H2,1-4H3,(H,24,29)(H,26,30,31)