N-(4-bromanyl-3-methyl-1,2-oxazol-5-yl)-3-[2-(6-methyl-1,3-benzodioxol-5-yl)ethyl]thiophene-2-sulfonamide

Systemtic Name: N-(4-bromanyl-3-methyl-1,2-oxazol-5-yl)-3-[2-(6-methyl-1,3-benzodioxol-5-yl)ethyl]thiophene-2-sulfonamide Openeye Name: N-(4-bromo-3-methyl-isoxazol-5-yl)-3-[2-(6-methyl-1,3-benzodioxol-5-yl)ethyl]thiophene-2-sulfonamide CAS Name: N-(4-bromo-3-methyl-5-isoxazolyl)-3-[2-(6-methyl-1,3-benzodioxol-5-yl)ethyl]-2-thiophenesulfonamide IUPAC Name: N-(4-bromo-3-methyl-1,2-oxazol-5-yl)-3-[2-(6-methyl-1,3-benzodioxol-5-yl)ethyl]thiophene-2-sulfonamide Traditional Name: N-(4-bromo-3-methyl-isoxazol-5-yl)-3-[2-(6-methyl-1,3-benzodioxol-5-yl)ethyl]thiophene-2-sulfonamide Formula: C18H17BrN2O5S2 MolecularWeight: 485.37198

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1CCC3=C(SC=C3)S(=O)(=O)NC4=C(C(=NO4)C)Br)OCO2

Isomeric SMILES

CC1=CC2=C(C=C1CCC3=C(SC=C3)S(=O)(=O)NC4=C(C(=NO4)C)Br)OCO2

InChI

InChI=1S/C18H17BrN2O5S2/c1-10-7-14-15(25-9-24-14)8-13(10)4-3-12-5-6-27-18(12)28(22,23)21-17-16(19)11(2)20-26-17/h5-8,21H,3-4,9H2,1-2H3