N-(4-acetamidophenyl)-2-[(6-oxidanylidene-3,7-dihydropurin-2-yl)sulfanyl]ethanamide

Systemtic Name: N-(4-acetamidophenyl)-2-[(6-oxidanylidene-3,7-dihydropurin-2-yl)sulfanyl]ethanamide Openeye Name: N-(4-acetamidophenyl)-2-[(6-oxo-3,7-dihydropurin-2-yl)sulfanyl]acetamide CAS Name: N-(4-acetamidophenyl)-2-[(6-oxo-3,7-dihydropurin-2-yl)thio]acetamide IUPAC Name: N-(4-acetamidophenyl)-2-[(6-oxo-3,7-dihydropurin-2-yl)sulfanyl]acetamide Traditional Name: N-(4-acetamidophenyl)-2-[(6-keto-3,7-dihydropurin-2-yl)thio]acetamide Formula: C15H14N6O3S MolecularWeight: 358.37506

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)NC(=O)CSC2=NC(=O)C3=C(N2)N=CN3

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)NC(=O)CSC2=NC(=O)C3=C(N2)N=CN3

InChI

InChI=1S/C15H14N6O3S/c1-8(22)18-9-2-4-10(5-3-9)19-11(23)6-25-15-20-13-12(14(24)21-15)16-7-17-13/h2-5,7H,6H2,1H3,(H,18,22)(H,19,23)(H2,16,17,20,21,24)