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

Systemtic Name: N-(4-bromanyl-3-methyl-1,2-oxazol-5-yl)-2-[(E)-3-(5-methyl-1,3-benzodioxol-4-yl)prop-2-enoyl]thiophene-3-sulfonamide Openeye Name: N-(4-bromo-3-methyl-isoxazol-5-yl)-2-[(E)-3-(5-methyl-1,3-benzodioxol-4-yl)prop-2-enoyl]thiophene-3-sulfonamide CAS Name: N-(4-bromo-3-methyl-5-isoxazolyl)-2-[(E)-3-(5-methyl-1,3-benzodioxol-4-yl)-1-oxoprop-2-enyl]-3-thiophenesulfonamide IUPAC Name: N-(4-bromo-3-methyl-1,2-oxazol-5-yl)-2-[(E)-3-(5-methyl-1,3-benzodioxol-4-yl)prop-2-enoyl]thiophene-3-sulfonamide Traditional Name: N-(4-bromo-3-methyl-isoxazol-5-yl)-2-[(E)-3-(5-methyl-1,3-benzodioxol-4-yl)acryloyl]thiophene-3-sulfonamide Formula: C19H15BrN2O6S2 MolecularWeight: 511.3662

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)OCO2)C=CC(=O)C3=C(C=CS3)S(=O)(=O)NC4=C(C(=NO4)C)Br

Isomeric SMILES

CC1=C(C2=C(C=C1)OCO2)/C=C/C(=O)C3=C(C=CS3)S(=O)(=O)NC4=C(C(=NO4)C)Br

InChI

InChI=1S/C19H15BrN2O6S2/c1-10-3-6-14-17(27-9-26-14)12(10)4-5-13(23)18-15(7-8-29-18)30(24,25)22-19-16(20)11(2)21-28-19/h3-8,22H,9H2,1-2H3/b5-4+