2-(3,4-dimethylphenyl)-8-oxidanylidene-9-(oxolan-2-ylmethyl)-7H-purine-6-carboxamide

Systemtic Name: 2-(3,4-dimethylphenyl)-8-oxidanylidene-9-(oxolan-2-ylmethyl)-7H-purine-6-carboxamide Openeye Name: 2-(3,4-dimethylphenyl)-8-oxo-9-(tetrahydrofuran-2-ylmethyl)-7H-purine-6-carboxamide CAS Name: 2-(3,4-dimethylphenyl)-8-oxo-9-(2-oxolanylmethyl)-7H-purine-6-carboxamide IUPAC Name: 2-(3,4-dimethylphenyl)-8-oxo-9-(oxolan-2-ylmethyl)-7H-purine-6-carboxamide Traditional Name: 2-(3,4-dimethylphenyl)-8-keto-9-(tetrahydrofurfuryl)-7H-purine-6-carboxamide Formula: C19H21N5O3 MolecularWeight: 367.40174

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NC(=C3C(=N2)N(C(=O)N3)CC4CCCO4)C(=O)N)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NC(=C3C(=N2)N(C(=O)N3)CC4CCCO4)C(=O)N)C

InChI

InChI=1S/C19H21N5O3/c1-10-5-6-12(8-11(10)2)17-21-14(16(20)25)15-18(23-17)24(19(26)22-15)9-13-4-3-7-27-13/h5-6,8,13H,3-4,7,9H2,1-2H3,(H2,20,25)(H,22,26)