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

Systemtic Name: N-(4-ethoxyphenyl)-2-(7H-purin-6-ylsulfanyl)ethanamide Openeye Name: N-(4-ethoxyphenyl)-2-(7H-purin-6-ylsulfanyl)acetamide CAS Name: N-(4-ethoxyphenyl)-2-(7H-purin-6-ylthio)acetamide IUPAC Name: N-(4-ethoxyphenyl)-2-(7H-purin-6-ylsulfanyl)acetamide Traditional Name: N-p-phenetyl-2-(7H-purin-6-ylthio)acetamide Formula: C15H15N5O2S MolecularWeight: 329.3769

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=O)CSC2=NC=NC3=C2NC=N3

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=O)CSC2=NC=NC3=C2NC=N3

InChI

InChI=1S/C15H15N5O2S/c1-2-22-11-5-3-10(4-6-11)20-12(21)7-23-15-13-14(17-8-16-13)18-9-19-15/h3-6,8-9H,2,7H2,1H3,(H,20,21)(H,16,17,18,19)