4-[2,6-bis(oxidanylidene)-1,3-dipropyl-7H-purin-8-yl]-N-propyl-cyclohexane-1-carboxamide

Systemtic Name: 4-[2,6-bis(oxidanylidene)-1,3-dipropyl-7H-purin-8-yl]-N-propyl-cyclohexane-1-carboxamide Openeye Name: 4-(2,6-dioxo-1,3-dipropyl-7H-purin-8-yl)-N-propyl-cyclohexanecarboxamide CAS Name: 4-(2,6-dioxo-1,3-dipropyl-7H-purin-8-yl)-N-propyl-1-cyclohexanecarboxamide IUPAC Name: 4-(2,6-dioxo-1,3-dipropyl-7H-purin-8-yl)-N-propylcyclohexane-1-carboxamide Traditional Name: 4-(2,6-diketo-1,3-dipropyl-7H-purin-8-yl)-N-propyl-cyclohexanecarboxamide Formula: C21H33N5O3 MolecularWeight: 403.51842

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C1CCC(CC1)C2=NC3=C(N2)C(=O)N(C(=O)N3CCC)CCC

Isomeric SMILES

CCCNC(=O)C1CCC(CC1)C2=NC3=C(N2)C(=O)N(C(=O)N3CCC)CCC

InChI

InChI=1S/C21H33N5O3/c1-4-11-22-19(27)15-9-7-14(8-10-15)17-23-16-18(24-17)25(12-5-2)21(29)26(13-6-3)20(16)28/h14-15H,4-13H2,1-3H3,(H,22,27)(H,23,24)