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

Systemtic Name: 3-[3-butyl-7-(2-methylpropyl)-2,6-bis(oxidanylidene)purin-8-yl]-N-(1-cyclopropylethyl)-N-methyl-propanamide Openeye Name: 3-(3-butyl-7-isobutyl-2,6-dioxo-purin-8-yl)-N-(1-cyclopropylethyl)-N-methyl-propanamide CAS Name: 3-[3-butyl-7-(2-methylpropyl)-2,6-dioxo-8-purinyl]-N-(1-cyclopropylethyl)-N-methylpropanamide IUPAC Name: 3-[3-butyl-7-(2-methylpropyl)-2,6-dioxopurin-8-yl]-N-(1-cyclopropylethyl)-N-methylpropanamide Traditional Name: 3-(3-butyl-7-isobutyl-2,6-diketo-purin-8-yl)-N-(1-cyclopropylethyl)-N-methyl-propionamide Formula: C22H35N5O3 MolecularWeight: 417.545

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C(=O)NC1=O)N(C(=N2)CCC(=O)N(C)C(C)C3CC3)CC(C)C

Isomeric SMILES

CCCCN1C2=C(C(=O)NC1=O)N(C(=N2)CCC(=O)N(C)C(C)C3CC3)CC(C)C

InChI

InChI=1S/C22H35N5O3/c1-6-7-12-26-20-19(21(29)24-22(26)30)27(13-14(2)3)17(23-20)10-11-18(28)25(5)15(4)16-8-9-16/h14-16H,6-13H2,1-5H3,(H,24,29,30)