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

Systemtic Name: 3-[3-butyl-7-(2-methylpropyl)-2,6-bis(oxidanylidene)purin-8-yl]-N-(furan-2-ylmethyl)-N-methyl-propanamide Openeye Name: 3-(3-butyl-7-isobutyl-2,6-dioxo-purin-8-yl)-N-(2-furylmethyl)-N-methyl-propanamide CAS Name: 3-[3-butyl-7-(2-methylpropyl)-2,6-dioxo-8-purinyl]-N-(2-furanylmethyl)-N-methylpropanamide IUPAC Name: 3-[3-butyl-7-(2-methylpropyl)-2,6-dioxopurin-8-yl]-N-(furan-2-ylmethyl)-N-methylpropanamide Traditional Name: 3-(3-butyl-7-isobutyl-2,6-diketo-purin-8-yl)-N-(2-furfuryl)-N-methyl-propionamide Formula: C22H31N5O4 MolecularWeight: 429.51264

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C(=O)NC1=O)N(C(=N2)CCC(=O)N(C)CC3=CC=CO3)CC(C)C

Isomeric SMILES

CCCCN1C2=C(C(=O)NC1=O)N(C(=N2)CCC(=O)N(C)CC3=CC=CO3)CC(C)C

InChI

InChI=1S/C22H31N5O4/c1-5-6-11-26-20-19(21(29)24-22(26)30)27(13-15(2)3)17(23-20)9-10-18(28)25(4)14-16-8-7-12-31-16/h7-8,12,15H,5-6,9-11,13-14H2,1-4H3,(H,24,29,30)