4-[1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]-N-hexyl-butanamide

Systemtic Name: 4-[1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]-N-hexyl-butanamide Openeye Name: 4-(1,3-dimethyl-2,6-dioxo-purin-7-yl)-N-hexyl-butanamide CAS Name: 4-(1,3-dimethyl-2,6-dioxo-7-purinyl)-N-hexylbutanamide IUPAC Name: 4-(1,3-dimethyl-2,6-dioxopurin-7-yl)-N-hexylbutanamide Traditional Name: 4-(2,6-diketo-1,3-dimethyl-purin-7-yl)-N-hexyl-butyramide Formula: C17H27N5O3 MolecularWeight: 349.42798

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCNC(=O)CCCN1C=NC2=C1C(=O)N(C(=O)N2C)C

Isomeric SMILES

CCCCCCNC(=O)CCCN1C=NC2=C1C(=O)N(C(=O)N2C)C

InChI

InChI=1S/C17H27N5O3/c1-4-5-6-7-10-18-13(23)9-8-11-22-12-19-15-14(22)16(24)21(3)17(25)20(15)2/h12H,4-11H2,1-3H3,(H,18,23)