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

Systemtic Name: N-(4-bromanyl-3-methyl-1,2-oxazol-5-yl)-3-[(E)-3-(2-methylphenyl)prop-2-enyl]thiophene-2-sulfonamide Openeye Name: N-(4-bromo-3-methyl-isoxazol-5-yl)-3-[(E)-3-(o-tolyl)allyl]thiophene-2-sulfonamide CAS Name: N-(4-bromo-3-methyl-5-isoxazolyl)-3-[(E)-3-(2-methylphenyl)prop-2-enyl]-2-thiophenesulfonamide IUPAC Name: N-(4-bromo-3-methyl-1,2-oxazol-5-yl)-3-[(E)-3-(2-methylphenyl)prop-2-enyl]thiophene-2-sulfonamide Traditional Name: N-(4-bromo-3-methyl-isoxazol-5-yl)-3-[(E)-3-(o-tolyl)allyl]thiophene-2-sulfonamide Formula: C18H17BrN2O3S2 MolecularWeight: 453.37318

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C=CCC2=C(SC=C2)S(=O)(=O)NC3=C(C(=NO3)C)Br

Isomeric SMILES

CC1=CC=CC=C1/C=C/CC2=C(SC=C2)S(=O)(=O)NC3=C(C(=NO3)C)Br

InChI

InChI=1S/C18H17BrN2O3S2/c1-12-6-3-4-7-14(12)8-5-9-15-10-11-25-18(15)26(22,23)21-17-16(19)13(2)20-24-17/h3-8,10-11,21H,9H2,1-2H3/b8-5+