N-[2-(5-bromanylpyridin-3-yl)-1,3-benzoxazol-5-yl]-2-(4-chlorophenyl)sulfanyl-ethanamide

Systemtic Name: N-[2-(5-bromanylpyridin-3-yl)-1,3-benzoxazol-5-yl]-2-(4-chlorophenyl)sulfanyl-ethanamide Openeye Name: N-[2-(5-bromo-3-pyridyl)-1,3-benzoxazol-5-yl]-2-(4-chlorophenyl)sulfanyl-acetamide CAS Name: N-[2-(5-bromo-3-pyridinyl)-1,3-benzoxazol-5-yl]-2-[(4-chlorophenyl)thio]acetamide IUPAC Name: N-[2-(5-bromopyridin-3-yl)-1,3-benzoxazol-5-yl]-2-(4-chlorophenyl)sulfanylacetamide Traditional Name: N-[2-(5-bromo-3-pyridyl)-1,3-benzoxazol-5-yl]-2-[(4-chlorophenyl)thio]acetamide Formula: C20H13BrClN3O2S MolecularWeight: 474.75812

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1SCC(=O)NC2=CC3=C(C=C2)OC(=N3)C4=CC(=CN=C4)Br)Cl

Isomeric SMILES

C1=CC(=CC=C1SCC(=O)NC2=CC3=C(C=C2)OC(=N3)C4=CC(=CN=C4)Br)Cl

InChI

InChI=1S/C20H13BrClN3O2S/c21-13-7-12(9-23-10-13)20-25-17-8-15(3-6-18(17)27-20)24-19(26)11-28-16-4-1-14(22)2-5-16/h1-10H,11H2,(H,24,26)