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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C=CCC3=C(SC=C3)S(=O)(=O)NC4=C(C(=NO4)C)Br)OCO2

Isomeric SMILES

CC1=CC2=C(C=C1/C=C/CC3=C(SC=C3)S(=O)(=O)NC4=C(C(=NO4)C)Br)OCO2

InChI

InChI=1S/C19H17BrN2O5S2/c1-11-8-15-16(26-10-25-15)9-14(11)5-3-4-13-6-7-28-19(13)29(23,24)22-18-17(20)12(2)21-27-18/h3,5-9,22H,4,10H2,1-2H3/b5-3+