N-[2-(2-chloranyl-4-methyl-phenyl)-1,3-benzoxazol-5-yl]-2-[1,3-dimethyl-2,6-bis(oxidanylidene)purin-9-yl]ethanamide

Systemtic Name: N-[2-(2-chloranyl-4-methyl-phenyl)-1,3-benzoxazol-5-yl]-2-[1,3-dimethyl-2,6-bis(oxidanylidene)purin-9-yl]ethanamide Openeye Name: N-[2-(2-chloro-4-methyl-phenyl)-1,3-benzoxazol-5-yl]-2-(1,3-dimethyl-2,6-dioxo-purin-9-yl)acetamide CAS Name: N-[2-(2-chloro-4-methylphenyl)-1,3-benzoxazol-5-yl]-2-(1,3-dimethyl-2,6-dioxo-9-purinyl)acetamide IUPAC Name: N-[2-(2-chloro-4-methylphenyl)-1,3-benzoxazol-5-yl]-2-(1,3-dimethyl-2,6-dioxopurin-9-yl)acetamide Traditional Name: N-[2-(2-chloro-4-methyl-phenyl)-1,3-benzoxazol-5-yl]-2-(2,6-diketo-1,3-dimethyl-purin-9-yl)acetamide Formula: C23H19ClN6O4 MolecularWeight: 478.88776

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C2=NC3=C(O2)C=CC(=C3)NC(=O)CN4C=NC5=C4N(C(=O)N(C5=O)C)C)Cl

Isomeric SMILES

CC1=CC(=C(C=C1)C2=NC3=C(O2)C=CC(=C3)NC(=O)CN4C=NC5=C4N(C(=O)N(C5=O)C)C)Cl

InChI

InChI=1S/C23H19ClN6O4/c1-12-4-6-14(15(24)8-12)20-27-16-9-13(5-7-17(16)34-20)26-18(31)10-30-11-25-19-21(30)28(2)23(33)29(3)22(19)32/h4-9,11H,10H2,1-3H3,(H,26,31)