2-[(2-chloranyl-7H-purin-6-yl)sulfanyl]-N-[2-(1H-indol-3-yl)ethyl]ethanamide

Systemtic Name: 2-[(2-chloranyl-7H-purin-6-yl)sulfanyl]-N-[2-(1H-indol-3-yl)ethyl]ethanamide Openeye Name: 2-[(2-chloro-7H-purin-6-yl)sulfanyl]-N-[2-(1H-indol-3-yl)ethyl]acetamide CAS Name: 2-[(2-chloro-7H-purin-6-yl)thio]-N-[2-(1H-indol-3-yl)ethyl]acetamide IUPAC Name: 2-[(2-chloro-7H-purin-6-yl)sulfanyl]-N-[2-(1H-indol-3-yl)ethyl]acetamide Traditional Name: 2-[(2-chloro-7H-purin-6-yl)thio]-N-[2-(1H-indol-3-yl)ethyl]acetamide Formula: C17H15ClN6OS MolecularWeight: 386.8586

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2)CCNC(=O)CSC3=NC(=NC4=C3NC=N4)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2)CCNC(=O)CSC3=NC(=NC4=C3NC=N4)Cl

InChI

InChI=1S/C17H15ClN6OS/c18-17-23-15-14(21-9-22-15)16(24-17)26-8-13(25)19-6-5-10-7-20-12-4-2-1-3-11(10)12/h1-4,7,9,20H,5-6,8H2,(H,19,25)(H,21,22,23,24)