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

Systemtic Name: N-butan-2-yl-3-[3-butyl-2,6-bis(oxidanylidene)-7-pentyl-purin-8-yl]propanamide Openeye Name: 3-(3-butyl-2,6-dioxo-7-pentyl-purin-8-yl)-N-sec-butyl-propanamide CAS Name: N-butan-2-yl-3-(3-butyl-2,6-dioxo-7-pentyl-8-purinyl)propanamide IUPAC Name: N-butan-2-yl-3-(3-butyl-2,6-dioxo-7-pentylpurin-8-yl)propanamide Traditional Name: 3-(7-amyl-3-butyl-2,6-diketo-purin-8-yl)-N-sec-butyl-propionamide Formula: C21H35N5O3 MolecularWeight: 405.5343

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H35N5O3/c1-5-8-10-14-25-16(11-12-17(27)22-15(4)7-3)23-19-18(25)20(28)24-21(29)26(19)13-9-6-2/h15H,5-14H2,1-4H3,(H,22,27)(H,24,28,29)