3-[3-butyl-7-(2-methylpropyl)-2,6-bis(oxidanylidene)purin-8-yl]-N-(1-ethylbenzimidazol-2-yl)propanamide

Systemtic Name: 3-[3-butyl-7-(2-methylpropyl)-2,6-bis(oxidanylidene)purin-8-yl]-N-(1-ethylbenzimidazol-2-yl)propanamide Openeye Name: 3-(3-butyl-7-isobutyl-2,6-dioxo-purin-8-yl)-N-(1-ethylbenzimidazol-2-yl)propanamide CAS Name: 3-[3-butyl-7-(2-methylpropyl)-2,6-dioxo-8-purinyl]-N-(1-ethyl-2-benzimidazolyl)propanamide IUPAC Name: 3-[3-butyl-7-(2-methylpropyl)-2,6-dioxopurin-8-yl]-N-(1-ethylbenzimidazol-2-yl)propanamide Traditional Name: 3-(3-butyl-7-isobutyl-2,6-diketo-purin-8-yl)-N-(1-ethylbenzimidazol-2-yl)propionamide Formula: C25H33N7O3 MolecularWeight: 479.57462

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C(=O)NC1=O)N(C(=N2)CCC(=O)NC3=NC4=CC=CC=C4N3CC)CC(C)C

Isomeric SMILES

CCCCN1C2=C(C(=O)NC1=O)N(C(=N2)CCC(=O)NC3=NC4=CC=CC=C4N3CC)CC(C)C

InChI

InChI=1S/C25H33N7O3/c1-5-7-14-31-22-21(23(34)29-25(31)35)32(15-16(3)4)19(27-22)12-13-20(33)28-24-26-17-10-8-9-11-18(17)30(24)6-2/h8-11,16H,5-7,12-15H2,1-4H3,(H,26,28,33)(H,29,34,35)