2-butyl-8-oxidanylidene-9-thiophen-2-yl-7H-purine-6-carboxamide

Systemtic Name: 2-butyl-8-oxidanylidene-9-thiophen-2-yl-7H-purine-6-carboxamide Openeye Name: 2-butyl-8-oxo-9-(2-thienyl)-7H-purine-6-carboxamide CAS Name: 2-butyl-8-oxo-9-thiophen-2-yl-7H-purine-6-carboxamide IUPAC Name: 2-butyl-8-oxo-9-thiophen-2-yl-7H-purine-6-carboxamide Traditional Name: 2-butyl-8-keto-9-(2-thienyl)-7H-purine-6-carboxamide Formula: C14H15N5O2S MolecularWeight: 317.3662

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC(=C2C(=N1)N(C(=O)N2)C3=CC=CS3)C(=O)N

Isomeric SMILES

CCCCC1=NC(=C2C(=N1)N(C(=O)N2)C3=CC=CS3)C(=O)N

InChI

InChI=1S/C14H15N5O2S/c1-2-3-5-8-16-10(12(15)20)11-13(17-8)19(14(21)18-11)9-6-4-7-22-9/h4,6-7H,2-3,5H2,1H3,(H2,15,20)(H,18,21)