9-(3-methoxyphenyl)-8-oxidanylidene-2-phenethyl-7H-purine-6-carboxamide

Systemtic Name: 9-(3-methoxyphenyl)-8-oxidanylidene-2-phenethyl-7H-purine-6-carboxamide Openeye Name: 9-(3-methoxyphenyl)-8-oxo-2-phenethyl-7H-purine-6-carboxamide CAS Name: 9-(3-methoxyphenyl)-8-oxo-2-phenethyl-7H-purine-6-carboxamide IUPAC Name: 9-(3-methoxyphenyl)-8-oxo-2-phenethyl-7H-purine-6-carboxamide Traditional Name: 8-keto-9-(3-methoxyphenyl)-2-phenethyl-7H-purine-6-carboxamide Formula: C21H19N5O3 MolecularWeight: 389.40726

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)N2C3=NC(=NC(=C3NC2=O)C(=O)N)CCC4=CC=CC=C4

Isomeric SMILES

COC1=CC=CC(=C1)N2C3=NC(=NC(=C3NC2=O)C(=O)N)CCC4=CC=CC=C4

InChI

InChI=1S/C21H19N5O3/c1-29-15-9-5-8-14(12-15)26-20-18(25-21(26)28)17(19(22)27)23-16(24-20)11-10-13-6-3-2-4-7-13/h2-9,12H,10-11H2,1H3,(H2,22,27)(H,25,28)