N-(5-chloranyl-2-methoxy-phenyl)-2-[(9-ethyl-6-oxidanylidene-3H-purin-8-yl)sulfanyl]ethanamide

Systemtic Name: N-(5-chloranyl-2-methoxy-phenyl)-2-[(9-ethyl-6-oxidanylidene-3H-purin-8-yl)sulfanyl]ethanamide Openeye Name: N-(5-chloro-2-methoxy-phenyl)-2-[(9-ethyl-6-oxo-3H-purin-8-yl)sulfanyl]acetamide CAS Name: N-(5-chloro-2-methoxyphenyl)-2-[(9-ethyl-6-oxo-3H-purin-8-yl)thio]acetamide IUPAC Name: N-(5-chloro-2-methoxyphenyl)-2-[(9-ethyl-6-oxo-3H-purin-8-yl)sulfanyl]acetamide Traditional Name: N-(5-chloro-2-methoxy-phenyl)-2-[(9-ethyl-6-keto-3H-purin-8-yl)thio]acetamide Formula: C16H16ClN5O3S MolecularWeight: 393.84794

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C(=O)N=CN2)N=C1SCC(=O)NC3=C(C=CC(=C3)Cl)OC

Isomeric SMILES

CCN1C2=C(C(=O)N=CN2)N=C1SCC(=O)NC3=C(C=CC(=C3)Cl)OC

InChI

InChI=1S/C16H16ClN5O3S/c1-3-22-14-13(15(24)19-8-18-14)21-16(22)26-7-12(23)20-10-6-9(17)4-5-11(10)25-2/h4-6,8H,3,7H2,1-2H3,(H,20,23)(H,18,19,24)