(4E)-4-[2-(4-bromanyl-2,5-dimethyl-phenyl)sulfanylethanoylhydrazinylidene]-4-thiophen-2-yl-butanoic acid

Systemtic Name: (4E)-4-[2-(4-bromanyl-2,5-dimethyl-phenyl)sulfanylethanoylhydrazinylidene]-4-thiophen-2-yl-butanoic acid Openeye Name: (4E)-4-[[2-(4-bromo-2,5-dimethyl-phenyl)sulfanylacetyl]hydrazono]-4-(2-thienyl)butanoic acid CAS Name: (4E)-4-[[2-[(4-bromo-2,5-dimethylphenyl)thio]-1-oxoethyl]hydrazinylidene]-4-thiophen-2-ylbutanoic acid IUPAC Name: (4E)-4-[[2-(4-bromo-2,5-dimethylphenyl)sulfanylacetyl]hydrazinylidene]-4-thiophen-2-ylbutanoic acid Traditional Name: (4E)-4-[[2-[(4-bromo-2,5-dimethyl-phenyl)thio]acetyl]hydrazono]-4-(2-thienyl)butyric acid Formula: C18H19BrN2O3S2 MolecularWeight: 455.38906

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1Br)C)SCC(=O)NN=C(CCC(=O)O)C2=CC=CS2

Isomeric SMILES

CC1=CC(=C(C=C1Br)C)SCC(=O)N/N=C(\CCC(=O)O)/C2=CC=CS2

InChI

InChI=1S/C18H19BrN2O3S2/c1-11-9-16(12(2)8-13(11)19)26-10-17(22)21-20-14(5-6-18(23)24)15-4-3-7-25-15/h3-4,7-9H,5-6,10H2,1-2H3,(H,21,22)(H,23,24)/b20-14+