4-[(4-chlorophenyl)methyl]-1-methyl-9-oxidanylidene-6,7-dihydroimidazo[1,2-a]purine-2-carbonitrile

Systemtic Name: 4-[(4-chlorophenyl)methyl]-1-methyl-9-oxidanylidene-6,7-dihydroimidazo[1,2-a]purine-2-carbonitrile Openeye Name: 4-[(4-chlorophenyl)methyl]-1-methyl-9-oxo-6,7-dihydroimidazo[1,2-a]purine-2-carbonitrile CAS Name: 4-[(4-chlorophenyl)methyl]-1-methyl-9-oxo-6,7-dihydroimidazo[1,2-a]purine-2-carbonitrile IUPAC Name: 4-[(4-chlorophenyl)methyl]-1-methyl-9-oxo-6,7-dihydroimidazo[1,2-a]purine-2-carbonitrile Traditional Name: 4-(4-chlorobenzyl)-9-keto-1-methyl-6,7-dihydroimidazo[1,2-a]purine-2-carbonitrile Formula: C16H13ClN6O MolecularWeight: 340.76702

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NC2=C1C(=O)N3CCN=C3N2CC4=CC=C(C=C4)Cl)C#N

Isomeric SMILES

CN1C(=NC2=C1C(=O)N3CCN=C3N2CC4=CC=C(C=C4)Cl)C#N

InChI

InChI=1S/C16H13ClN6O/c1-21-12(8-18)20-14-13(21)15(24)22-7-6-19-16(22)23(14)9-10-2-4-11(17)5-3-10/h2-5H,6-7,9H2,1H3