9-(4-tert-butylphenyl)-8-oxidanylidene-2-thiophen-2-yl-7H-purine-6-carboxamide

Systemtic Name: 9-(4-tert-butylphenyl)-8-oxidanylidene-2-thiophen-2-yl-7H-purine-6-carboxamide Openeye Name: 9-(4-tert-butylphenyl)-8-oxo-2-(2-thienyl)-7H-purine-6-carboxamide CAS Name: 9-(4-tert-butylphenyl)-8-oxo-2-thiophen-2-yl-7H-purine-6-carboxamide IUPAC Name: 9-(4-tert-butylphenyl)-8-oxo-2-thiophen-2-yl-7H-purine-6-carboxamide Traditional Name: 9-(4-tert-butylphenyl)-8-keto-2-(2-thienyl)-7H-purine-6-carboxamide Formula: C20H19N5O2S MolecularWeight: 393.46216

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)N2C3=NC(=NC(=C3NC2=O)C(=O)N)C4=CC=CS4

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)N2C3=NC(=NC(=C3NC2=O)C(=O)N)C4=CC=CS4

InChI

InChI=1S/C20H19N5O2S/c1-20(2,3)11-6-8-12(9-7-11)25-18-15(23-19(25)27)14(16(21)26)22-17(24-18)13-5-4-10-28-13/h4-10H,1-3H3,(H2,21,26)(H,23,27)