N-phenethyl-2-(7H-purin-6-ylsulfanyl)ethanamide

Systemtic Name: N-phenethyl-2-(7H-purin-6-ylsulfanyl)ethanamide Openeye Name: N-phenethyl-2-(7H-purin-6-ylsulfanyl)acetamide CAS Name: N-phenethyl-2-(7H-purin-6-ylthio)acetamide IUPAC Name: N-phenethyl-2-(7H-purin-6-ylsulfanyl)acetamide Traditional Name: N-phenethyl-2-(7H-purin-6-ylthio)acetamide Formula: C15H15N5OS MolecularWeight: 313.3775

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H15N5OS/c21-12(16-7-6-11-4-2-1-3-5-11)8-22-15-13-14(18-9-17-13)19-10-20-15/h1-5,9-10H,6-8H2,(H,16,21)(H,17,18,19,20)