N-[2-[(5-bromanylthiophen-2-yl)methylsulfanyl]ethyl]-2-(2-oxidanylidene-1,3-benzoxazol-3-yl)propanamide

Systemtic Name: N-[2-[(5-bromanylthiophen-2-yl)methylsulfanyl]ethyl]-2-(2-oxidanylidene-1,3-benzoxazol-3-yl)propanamide Openeye Name: N-[2-[(5-bromo-2-thienyl)methylsulfanyl]ethyl]-2-(2-oxo-1,3-benzoxazol-3-yl)propanamide CAS Name: N-[2-[(5-bromo-2-thiophenyl)methylthio]ethyl]-2-(2-oxo-1,3-benzoxazol-3-yl)propanamide IUPAC Name: N-[2-[(5-bromothiophen-2-yl)methylsulfanyl]ethyl]-2-(2-oxo-1,3-benzoxazol-3-yl)propanamide Traditional Name: N-[2-[(5-bromo-2-thienyl)methylthio]ethyl]-2-(2-keto-1,3-benzoxazol-3-yl)propionamide Formula: C17H17BrN2O3S2 MolecularWeight: 441.36248

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCCSCC1=CC=C(S1)Br)N2C3=CC=CC=C3OC2=O

Isomeric SMILES

CC(C(=O)NCCSCC1=CC=C(S1)Br)N2C3=CC=CC=C3OC2=O

InChI

InChI=1S/C17H17BrN2O3S2/c1-11(20-13-4-2-3-5-14(13)23-17(20)22)16(21)19-8-9-24-10-12-6-7-15(18)25-12/h2-7,11H,8-10H2,1H3,(H,19,21)