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

Systemtic Name: N-butan-2-yl-3-[3-butyl-7-(2-methylpropyl)-2,6-bis(oxidanylidene)purin-8-yl]propanamide Openeye Name: 3-(3-butyl-7-isobutyl-2,6-dioxo-purin-8-yl)-N-sec-butyl-propanamide CAS Name: N-butan-2-yl-3-[3-butyl-7-(2-methylpropyl)-2,6-dioxo-8-purinyl]propanamide IUPAC Name: N-butan-2-yl-3-[3-butyl-7-(2-methylpropyl)-2,6-dioxopurin-8-yl]propanamide Traditional Name: 3-(3-butyl-7-isobutyl-2,6-diketo-purin-8-yl)-N-sec-butyl-propionamide Formula: C20H33N5O3 MolecularWeight: 391.50772

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C(=O)NC1=O)N(C(=N2)CCC(=O)NC(C)CC)CC(C)C

Isomeric SMILES

CCCCN1C2=C(C(=O)NC1=O)N(C(=N2)CCC(=O)NC(C)CC)CC(C)C

InChI

InChI=1S/C20H33N5O3/c1-6-8-11-24-18-17(19(27)23-20(24)28)25(12-13(3)4)15(22-18)9-10-16(26)21-14(5)7-2/h13-14H,6-12H2,1-5H3,(H,21,26)(H,23,27,28)