N-(7-octanoyl-4-oxidanylidene-1H-pyrrolo[2,3-d]pyrimidin-2-yl)octanamide

Systemtic Name: N-(7-octanoyl-4-oxidanylidene-1H-pyrrolo[2,3-d]pyrimidin-2-yl)octanamide Openeye Name: N-(7-octanoyl-4-oxo-1H-pyrrolo[2,3-d]pyrimidin-2-yl)octanamide CAS Name: N-[4-oxo-7-(1-oxooctyl)-1H-pyrrolo[2,3-d]pyrimidin-2-yl]octanamide IUPAC Name: N-(7-octanoyl-4-oxo-1H-pyrrolo[2,3-d]pyrimidin-2-yl)octanamide Traditional Name: N-(7-caprylyl-4-keto-1H-pyrrolo[2,3-d]pyrimidin-2-yl)caprylamide Formula: C22H34N4O3 MolecularWeight: 402.53036

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)NC1=NC(=O)C2=C(N1)N(C=C2)C(=O)CCCCCCC

Isomeric SMILES

CCCCCCCC(=O)NC1=NC(=O)C2=C(N1)N(C=C2)C(=O)CCCCCCC

InChI

InChI=1S/C22H34N4O3/c1-3-5-7-9-11-13-18(27)23-22-24-20-17(21(29)25-22)15-16-26(20)19(28)14-12-10-8-6-4-2/h15-16H,3-14H2,1-2H3,(H2,23,24,25,27,29)