N-[2-(5-bromanyl-2-chloranyl-phenyl)-1,3-benzoxazol-5-yl]-2-phenylsulfanyl-ethanamide

Systemtic Name: N-[2-(5-bromanyl-2-chloranyl-phenyl)-1,3-benzoxazol-5-yl]-2-phenylsulfanyl-ethanamide Openeye Name: N-[2-(5-bromo-2-chloro-phenyl)-1,3-benzoxazol-5-yl]-2-phenylsulfanyl-acetamide CAS Name: N-[2-(5-bromo-2-chlorophenyl)-1,3-benzoxazol-5-yl]-2-(phenylthio)acetamide IUPAC Name: N-[2-(5-bromo-2-chlorophenyl)-1,3-benzoxazol-5-yl]-2-phenylsulfanylacetamide Traditional Name: N-[2-(5-bromo-2-chloro-phenyl)-1,3-benzoxazol-5-yl]-2-(phenylthio)acetamide Formula: C21H14BrClN2O2S MolecularWeight: 473.77006

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H14BrClN2O2S/c22-13-6-8-17(23)16(10-13)21-25-18-11-14(7-9-19(18)27-21)24-20(26)12-28-15-4-2-1-3-5-15/h1-11H,12H2,(H,24,26)