N-(4-bromanyl-3-methyl-1,2-oxazol-5-yl)-2-butyl-1-benzothiophene-3-sulfonamide

Systemtic Name: N-(4-bromanyl-3-methyl-1,2-oxazol-5-yl)-2-butyl-1-benzothiophene-3-sulfonamide Openeye Name: N-(4-bromo-3-methyl-isoxazol-5-yl)-2-butyl-benzothiophene-3-sulfonamide CAS Name: N-(4-bromo-3-methyl-5-isoxazolyl)-2-butyl-1-benzothiophene-3-sulfonamide IUPAC Name: N-(4-bromo-3-methyl-1,2-oxazol-5-yl)-2-butyl-1-benzothiophene-3-sulfonamide Traditional Name: N-(4-bromo-3-methyl-isoxazol-5-yl)-2-butyl-benzothiophene-3-sulfonamide Formula: C16H17BrN2O3S2 MolecularWeight: 429.35178

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C2=CC=CC=C2S1)S(=O)(=O)NC3=C(C(=NO3)C)Br

Isomeric SMILES

CCCCC1=C(C2=CC=CC=C2S1)S(=O)(=O)NC3=C(C(=NO3)C)Br

InChI

InChI=1S/C16H17BrN2O3S2/c1-3-4-8-13-15(11-7-5-6-9-12(11)23-13)24(20,21)19-16-14(17)10(2)18-22-16/h5-7,9,19H,3-4,8H2,1-2H3