ethyl 2-[2-[(6-bromanyl-1,3-benzodioxol-5-yl)methylsulfanyl]-1,3-thiazol-4-yl]ethanoate

Systemtic Name: ethyl 2-[2-[(6-bromanyl-1,3-benzodioxol-5-yl)methylsulfanyl]-1,3-thiazol-4-yl]ethanoate Openeye Name: ethyl 2-[2-[(6-bromo-1,3-benzodioxol-5-yl)methylsulfanyl]thiazol-4-yl]acetate CAS Name: 2-[2-[(6-bromo-1,3-benzodioxol-5-yl)methylthio]-4-thiazolyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[2-[(6-bromo-1,3-benzodioxol-5-yl)methylsulfanyl]-1,3-thiazol-4-yl]acetate Traditional Name: 2-[2-[(6-bromo-1,3-benzodioxol-5-yl)methylthio]thiazol-4-yl]acetic acid ethyl ester Formula: C15H14BrNO4S2 MolecularWeight: 416.30996

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1=CSC(=N1)SCC2=CC3=C(C=C2Br)OCO3

Isomeric SMILES

CCOC(=O)CC1=CSC(=N1)SCC2=CC3=C(C=C2Br)OCO3

InChI

InChI=1S/C15H14BrNO4S2/c1-2-19-14(18)4-10-7-23-15(17-10)22-6-9-3-12-13(5-11(9)16)21-8-20-12/h3,5,7H,2,4,6,8H2,1H3