N-(4-acetamidophenyl)-2-[(2-azanyl-6-oxidanylidene-3,7-dihydropurin-8-yl)sulfanyl]ethanamide

Systemtic Name: N-(4-acetamidophenyl)-2-[(2-azanyl-6-oxidanylidene-3,7-dihydropurin-8-yl)sulfanyl]ethanamide Openeye Name: N-(4-acetamidophenyl)-2-[(2-amino-6-oxo-3,7-dihydropurin-8-yl)sulfanyl]acetamide CAS Name: N-(4-acetamidophenyl)-2-[(2-amino-6-oxo-3,7-dihydropurin-8-yl)thio]acetamide IUPAC Name: N-(4-acetamidophenyl)-2-[(2-amino-6-oxo-3,7-dihydropurin-8-yl)sulfanyl]acetamide Traditional Name: N-(4-acetamidophenyl)-2-[(2-amino-6-keto-3,7-dihydropurin-8-yl)thio]acetamide Formula: C15H15N7O3S MolecularWeight: 373.3897

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)NC(=O)CSC2=NC3=C(N2)C(=O)N=C(N3)N

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)NC(=O)CSC2=NC3=C(N2)C(=O)N=C(N3)N

InChI

InChI=1S/C15H15N7O3S/c1-7(23)17-8-2-4-9(5-3-8)18-10(24)6-26-15-19-11-12(21-15)20-14(16)22-13(11)25/h2-5H,6H2,1H3,(H,17,23)(H,18,24)(H4,16,19,20,21,22,25)