8-oxidanylidene-9-(phenylmethyl)-2-thiophen-3-yl-7H-purine-6-carboxamide

Systemtic Name: 8-oxidanylidene-9-(phenylmethyl)-2-thiophen-3-yl-7H-purine-6-carboxamide Openeye Name: 9-benzyl-8-oxo-2-(3-thienyl)-7H-purine-6-carboxamide CAS Name: 8-oxo-9-(phenylmethyl)-2-(3-thiophenyl)-7H-purine-6-carboxamide IUPAC Name: 9-benzyl-8-oxo-2-thiophen-3-yl-7H-purine-6-carboxamide Traditional Name: 9-benzyl-8-keto-2-(3-thienyl)-7H-purine-6-carboxamide Formula: C17H13N5O2S MolecularWeight: 351.38242

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C3=NC(=NC(=C3NC2=O)C(=O)N)C4=CSC=C4

Isomeric SMILES

C1=CC=C(C=C1)CN2C3=NC(=NC(=C3NC2=O)C(=O)N)C4=CSC=C4

InChI

InChI=1S/C17H13N5O2S/c18-14(23)12-13-16(21-15(19-12)11-6-7-25-9-11)22(17(24)20-13)8-10-4-2-1-3-5-10/h1-7,9H,8H2,(H2,18,23)(H,20,24)