2-[(6-bromanyl-1,3-benzoxazol-2-yl)sulfanyl]-N-butyl-ethanamide

Systemtic Name: 2-[(6-bromanyl-1,3-benzoxazol-2-yl)sulfanyl]-N-butyl-ethanamide Openeye Name: 2-[(6-bromo-1,3-benzoxazol-2-yl)sulfanyl]-N-butyl-acetamide CAS Name: 2-[(6-bromo-1,3-benzoxazol-2-yl)thio]-N-butylacetamide IUPAC Name: 2-[(6-bromo-1,3-benzoxazol-2-yl)sulfanyl]-N-butylacetamide Traditional Name: 2-[(6-bromo-1,3-benzoxazol-2-yl)thio]-N-butyl-acetamide Formula: C13H15BrN2O2S MolecularWeight: 343.2394

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)CSC1=NC2=C(O1)C=C(C=C2)Br

Isomeric SMILES

CCCCNC(=O)CSC1=NC2=C(O1)C=C(C=C2)Br

InChI

InChI=1S/C13H15BrN2O2S/c1-2-3-6-15-12(17)8-19-13-16-10-5-4-9(14)7-11(10)18-13/h4-5,7H,2-3,6,8H2,1H3,(H,15,17)