2-[2-(4-chlorophenyl)-7-methyl-8-oxidanylidene-purin-9-yl]-N-ethyl-N-(phenylmethyl)ethanamide

Systemtic Name: 2-[2-(4-chlorophenyl)-7-methyl-8-oxidanylidene-purin-9-yl]-N-ethyl-N-(phenylmethyl)ethanamide Openeye Name: N-benzyl-2-[2-(4-chlorophenyl)-7-methyl-8-oxo-purin-9-yl]-N-ethyl-acetamide CAS Name: 2-[2-(4-chlorophenyl)-7-methyl-8-oxo-9-purinyl]-N-ethyl-N-(phenylmethyl)acetamide IUPAC Name: N-benzyl-2-[2-(4-chlorophenyl)-7-methyl-8-oxopurin-9-yl]-N-ethylacetamide Traditional Name: N-benzyl-2-[2-(4-chlorophenyl)-8-keto-7-methyl-purin-9-yl]-N-ethyl-acetamide Formula: C23H22ClN5O2 MolecularWeight: 435.90608

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC=CC=C1)C(=O)CN2C3=NC(=NC=C3N(C2=O)C)C4=CC=C(C=C4)Cl

Isomeric SMILES

CCN(CC1=CC=CC=C1)C(=O)CN2C3=NC(=NC=C3N(C2=O)C)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C23H22ClN5O2/c1-3-28(14-16-7-5-4-6-8-16)20(30)15-29-22-19(27(2)23(29)31)13-25-21(26-22)17-9-11-18(24)12-10-17/h4-13H,3,14-15H2,1-2H3