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

Systemtic Name: N-(4-bromanyl-3-methyl-1,2-oxazol-5-yl)-2-[(E)-3-(2,4-dimethylphenyl)prop-2-enyl]thiophene-3-sulfonamide Openeye Name: N-(4-bromo-3-methyl-isoxazol-5-yl)-2-[(E)-3-(2,4-dimethylphenyl)allyl]thiophene-3-sulfonamide CAS Name: N-(4-bromo-3-methyl-5-isoxazolyl)-2-[(E)-3-(2,4-dimethylphenyl)prop-2-enyl]-3-thiophenesulfonamide IUPAC Name: N-(4-bromo-3-methyl-1,2-oxazol-5-yl)-2-[(E)-3-(2,4-dimethylphenyl)prop-2-enyl]thiophene-3-sulfonamide Traditional Name: N-(4-bromo-3-methyl-isoxazol-5-yl)-2-[(E)-3-(2,4-dimethylphenyl)allyl]thiophene-3-sulfonamide Formula: C19H19BrN2O3S2 MolecularWeight: 467.39976

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C=CCC2=C(C=CS2)S(=O)(=O)NC3=C(C(=NO3)C)Br)C

Isomeric SMILES

CC1=CC(=C(C=C1)/C=C/CC2=C(C=CS2)S(=O)(=O)NC3=C(C(=NO3)C)Br)C

InChI

InChI=1S/C19H19BrN2O3S2/c1-12-7-8-15(13(2)11-12)5-4-6-16-17(9-10-26-16)27(23,24)22-19-18(20)14(3)21-25-19/h4-5,7-11,22H,6H2,1-3H3/b5-4+