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

Systemtic Name: 3-[3-butyl-2,6-bis(oxidanylidene)-7-pentyl-purin-8-yl]-N-propan-2-yl-propanamide Openeye Name: 3-(3-butyl-2,6-dioxo-7-pentyl-purin-8-yl)-N-isopropyl-propanamide CAS Name: 3-(3-butyl-2,6-dioxo-7-pentyl-8-purinyl)-N-propan-2-ylpropanamide IUPAC Name: 3-(3-butyl-2,6-dioxo-7-pentylpurin-8-yl)-N-propan-2-ylpropanamide Traditional Name: 3-(7-amyl-3-butyl-2,6-diketo-purin-8-yl)-N-isopropyl-propionamide Formula: C20H33N5O3 MolecularWeight: 391.50772

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C(=NC2=C1C(=O)NC(=O)N2CCCC)CCC(=O)NC(C)C

Isomeric SMILES

CCCCCN1C(=NC2=C1C(=O)NC(=O)N2CCCC)CCC(=O)NC(C)C

InChI

InChI=1S/C20H33N5O3/c1-5-7-9-13-24-15(10-11-16(26)21-14(3)4)22-18-17(24)19(27)23-20(28)25(18)12-8-6-2/h14H,5-13H2,1-4H3,(H,21,26)(H,23,27,28)