7-chloranyl-4,6-dimethyl-1-(phenylmethyl)imidazo[1,2-a]purin-9-one

Systemtic Name: 7-chloranyl-4,6-dimethyl-1-(phenylmethyl)imidazo[1,2-a]purin-9-one Openeye Name: 1-benzyl-7-chloro-4,6-dimethyl-imidazo[1,2-a]purin-9-one CAS Name: 7-chloro-4,6-dimethyl-1-(phenylmethyl)-9-imidazo[1,2-a]purinone IUPAC Name: 1-benzyl-7-chloro-4,6-dimethylimidazo[1,2-a]purin-9-one Traditional Name: 1-benzyl-7-chloro-4,6-dimethyl-imidazo[1,2-a]purin-9-one Formula: C16H14ClN5O MolecularWeight: 327.76826

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N2C(=O)C3=C(N=CN3CC4=CC=CC=C4)N(C2=N1)C)Cl

Isomeric SMILES

CC1=C(N2C(=O)C3=C(N=CN3CC4=CC=CC=C4)N(C2=N1)C)Cl

InChI

InChI=1S/C16H14ClN5O/c1-10-13(17)22-15(23)12-14(20(2)16(22)19-10)18-9-21(12)8-11-6-4-3-5-7-11/h3-7,9H,8H2,1-2H3