N-[6-(4-chlorophenyl)sulfanyl-7H-purin-2-yl]-2-phenyl-ethanamide

Systemtic Name: N-[6-(4-chlorophenyl)sulfanyl-7H-purin-2-yl]-2-phenyl-ethanamide Openeye Name: N-[6-(4-chlorophenyl)sulfanyl-7H-purin-2-yl]-2-phenyl-acetamide CAS Name: N-[6-[(4-chlorophenyl)thio]-7H-purin-2-yl]-2-phenylacetamide IUPAC Name: N-[6-(4-chlorophenyl)sulfanyl-7H-purin-2-yl]-2-phenylacetamide Traditional Name: N-[6-[(4-chlorophenyl)thio]-7H-purin-2-yl]-2-phenyl-acetamide Formula: C19H14ClN5OS MolecularWeight: 395.86536

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(=O)NC2=NC3=C(C(=N2)SC4=CC=C(C=C4)Cl)NC=N3

Isomeric SMILES

C1=CC=C(C=C1)CC(=O)NC2=NC3=C(C(=N2)SC4=CC=C(C=C4)Cl)NC=N3

InChI

InChI=1S/C19H14ClN5OS/c20-13-6-8-14(9-7-13)27-18-16-17(22-11-21-16)24-19(25-18)23-15(26)10-12-4-2-1-3-5-12/h1-9,11H,10H2,(H2,21,22,23,24,25,26)