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

Systemtic Name: N-(4-bromanyl-3-methyl-1,2-oxazol-5-yl)-2-[(E)-3-(6-methyl-1,3-benzodioxol-5-yl)prop-2-enyl]thiophene-3-sulfonamide Openeye Name: N-(4-bromo-3-methyl-isoxazol-5-yl)-2-[(E)-3-(6-methyl-1,3-benzodioxol-5-yl)allyl]thiophene-3-sulfonamide CAS Name: N-(4-bromo-3-methyl-5-isoxazolyl)-2-[(E)-3-(6-methyl-1,3-benzodioxol-5-yl)prop-2-enyl]-3-thiophenesulfonamide IUPAC Name: N-(4-bromo-3-methyl-1,2-oxazol-5-yl)-2-[(E)-3-(6-methyl-1,3-benzodioxol-5-yl)prop-2-enyl]thiophene-3-sulfonamide Traditional Name: N-(4-bromo-3-methyl-isoxazol-5-yl)-2-[(E)-3-(6-methyl-1,3-benzodioxol-5-yl)allyl]thiophene-3-sulfonamide Formula: C19H17BrN2O5S2 MolecularWeight: 497.38268

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C=CCC3=C(C=CS3)S(=O)(=O)NC4=C(C(=NO4)C)Br)OCO2

Isomeric SMILES

CC1=CC2=C(C=C1/C=C/CC3=C(C=CS3)S(=O)(=O)NC4=C(C(=NO4)C)Br)OCO2

InChI

InChI=1S/C19H17BrN2O5S2/c1-11-8-14-15(26-10-25-14)9-13(11)4-3-5-16-17(6-7-28-16)29(23,24)22-19-18(20)12(2)21-27-19/h3-4,6-9,22H,5,10H2,1-2H3/b4-3+