N-(4-phenoxyphenyl)-2-(7H-purin-6-ylsulfanyl)ethanamide

Systemtic Name: N-(4-phenoxyphenyl)-2-(7H-purin-6-ylsulfanyl)ethanamide Openeye Name: N-(4-phenoxyphenyl)-2-(7H-purin-6-ylsulfanyl)acetamide CAS Name: N-(4-phenoxyphenyl)-2-(7H-purin-6-ylthio)acetamide IUPAC Name: N-(4-phenoxyphenyl)-2-(7H-purin-6-ylsulfanyl)acetamide Traditional Name: N-(4-phenoxyphenyl)-2-(7H-purin-6-ylthio)acetamide Formula: C19H15N5O2S MolecularWeight: 377.4197

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=CC=C(C=C2)NC(=O)CSC3=NC=NC4=C3NC=N4

Isomeric SMILES

C1=CC=C(C=C1)OC2=CC=C(C=C2)NC(=O)CSC3=NC=NC4=C3NC=N4

InChI

InChI=1S/C19H15N5O2S/c25-16(10-27-19-17-18(21-11-20-17)22-12-23-19)24-13-6-8-15(9-7-13)26-14-4-2-1-3-5-14/h1-9,11-12H,10H2,(H,24,25)(H,20,21,22,23)