9-(3-chlorophenyl)-2-(2-methylpropyl)-8-oxidanylidene-7H-purine-6-carboxamide

Systemtic Name: 9-(3-chlorophenyl)-2-(2-methylpropyl)-8-oxidanylidene-7H-purine-6-carboxamide Openeye Name: 9-(3-chlorophenyl)-2-isobutyl-8-oxo-7H-purine-6-carboxamide CAS Name: 9-(3-chlorophenyl)-2-(2-methylpropyl)-8-oxo-7H-purine-6-carboxamide IUPAC Name: 9-(3-chlorophenyl)-2-(2-methylpropyl)-8-oxo-7H-purine-6-carboxamide Traditional Name: 9-(3-chlorophenyl)-2-isobutyl-8-keto-7H-purine-6-carboxamide Formula: C16H16ClN5O2 MolecularWeight: 345.78354

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=NC(=C2C(=N1)N(C(=O)N2)C3=CC(=CC=C3)Cl)C(=O)N

Isomeric SMILES

CC(C)CC1=NC(=C2C(=N1)N(C(=O)N2)C3=CC(=CC=C3)Cl)C(=O)N

InChI

InChI=1S/C16H16ClN5O2/c1-8(2)6-11-19-12(14(18)23)13-15(20-11)22(16(24)21-13)10-5-3-4-9(17)7-10/h3-5,7-8H,6H2,1-2H3,(H2,18,23)(H,21,24)