N-[2-[(5-bromanylthiophen-2-yl)methylsulfanyl]ethyl]-3,5-dimethyl-1,2-oxazole-4-carboxamide

Systemtic Name: N-[2-[(5-bromanylthiophen-2-yl)methylsulfanyl]ethyl]-3,5-dimethyl-1,2-oxazole-4-carboxamide Openeye Name: N-[2-[(5-bromo-2-thienyl)methylsulfanyl]ethyl]-3,5-dimethyl-isoxazole-4-carboxamide CAS Name: N-[2-[(5-bromo-2-thiophenyl)methylthio]ethyl]-3,5-dimethyl-4-isoxazolecarboxamide IUPAC Name: N-[2-[(5-bromothiophen-2-yl)methylsulfanyl]ethyl]-3,5-dimethyl-1,2-oxazole-4-carboxamide Traditional Name: N-[2-[(5-bromo-2-thienyl)methylthio]ethyl]-3,5-dimethyl-isoxazole-4-carboxamide Formula: C13H15BrN2O2S2 MolecularWeight: 375.3044

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)C(=O)NCCSCC2=CC=C(S2)Br

Isomeric SMILES

CC1=C(C(=NO1)C)C(=O)NCCSCC2=CC=C(S2)Br

InChI

InChI=1S/C13H15BrN2O2S2/c1-8-12(9(2)18-16-8)13(17)15-5-6-19-7-10-3-4-11(14)20-10/h3-4H,5-7H2,1-2H3,(H,15,17)