2-[(E)-3-(1,3-benzodioxol-5-yl)prop-2-enyl]-N-(4-bromanyl-3-methyl-1,2-oxazol-5-yl)thiophene-3-sulfonamide

Systemtic Name: 2-[(E)-3-(1,3-benzodioxol-5-yl)prop-2-enyl]-N-(4-bromanyl-3-methyl-1,2-oxazol-5-yl)thiophene-3-sulfonamide Openeye Name: 2-[(E)-3-(1,3-benzodioxol-5-yl)allyl]-N-(4-bromo-3-methyl-isoxazol-5-yl)thiophene-3-sulfonamide CAS Name: 2-[(E)-3-(1,3-benzodioxol-5-yl)prop-2-enyl]-N-(4-bromo-3-methyl-5-isoxazolyl)-3-thiophenesulfonamide IUPAC Name: 2-[(E)-3-(1,3-benzodioxol-5-yl)prop-2-enyl]-N-(4-bromo-3-methyl-1,2-oxazol-5-yl)thiophene-3-sulfonamide Traditional Name: 2-[(E)-3-(1,3-benzodioxol-5-yl)allyl]-N-(4-bromo-3-methyl-isoxazol-5-yl)thiophene-3-sulfonamide Formula: C18H15BrN2O5S2 MolecularWeight: 483.3561

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC(=C1Br)NS(=O)(=O)C2=C(SC=C2)CC=CC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC1=NOC(=C1Br)NS(=O)(=O)C2=C(SC=C2)C/C=C/C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C18H15BrN2O5S2/c1-11-17(19)18(26-20-11)21-28(22,23)16-7-8-27-15(16)4-2-3-12-5-6-13-14(9-12)25-10-24-13/h2-3,5-9,21H,4,10H2,1H3/b3-2+