2-[2-(4-chlorophenyl)-8-oxidanylidene-7H-purin-9-yl]-N,N-dipropyl-ethanamide

Systemtic Name: 2-[2-(4-chlorophenyl)-8-oxidanylidene-7H-purin-9-yl]-N,N-dipropyl-ethanamide Openeye Name: 2-[2-(4-chlorophenyl)-8-oxo-7H-purin-9-yl]-N,N-dipropyl-acetamide CAS Name: 2-[2-(4-chlorophenyl)-8-oxo-7H-purin-9-yl]-N,N-dipropylacetamide IUPAC Name: 2-[2-(4-chlorophenyl)-8-oxo-7H-purin-9-yl]-N,N-dipropylacetamide Traditional Name: 2-[2-(4-chlorophenyl)-8-keto-7H-purin-9-yl]-N,N-dipropyl-acetamide Formula: C19H22ClN5O2 MolecularWeight: 387.86328

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCC)C(=O)CN1C2=NC(=NC=C2NC1=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CCCN(CCC)C(=O)CN1C2=NC(=NC=C2NC1=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C19H22ClN5O2/c1-3-9-24(10-4-2)16(26)12-25-18-15(22-19(25)27)11-21-17(23-18)13-5-7-14(20)8-6-13/h5-8,11H,3-4,9-10,12H2,1-2H3,(H,22,27)