9-cyclohexyl-2-(4-methoxyphenyl)-8-oxidanylidene-7H-purine-6-carboxamide

Systemtic Name: 9-cyclohexyl-2-(4-methoxyphenyl)-8-oxidanylidene-7H-purine-6-carboxamide Openeye Name: 9-cyclohexyl-2-(4-methoxyphenyl)-8-oxo-7H-purine-6-carboxamide CAS Name: 9-cyclohexyl-2-(4-methoxyphenyl)-8-oxo-7H-purine-6-carboxamide IUPAC Name: 9-cyclohexyl-2-(4-methoxyphenyl)-8-oxo-7H-purine-6-carboxamide Traditional Name: 9-cyclohexyl-8-keto-2-(4-methoxyphenyl)-7H-purine-6-carboxamide Formula: C19H21N5O3 MolecularWeight: 367.40174

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NC(=C3C(=N2)N(C(=O)N3)C4CCCCC4)C(=O)N

Isomeric SMILES

COC1=CC=C(C=C1)C2=NC(=C3C(=N2)N(C(=O)N3)C4CCCCC4)C(=O)N

InChI

InChI=1S/C19H21N5O3/c1-27-13-9-7-11(8-10-13)17-21-14(16(20)25)15-18(23-17)24(19(26)22-15)12-5-3-2-4-6-12/h7-10,12H,2-6H2,1H3,(H2,20,25)(H,22,26)