5-[[(4-bromanyl-3-methyl-phenyl)amino]methyl]-4-methyl-thiophene-2-carboxylic acid

Systemtic Name: 5-[[(4-bromanyl-3-methyl-phenyl)amino]methyl]-4-methyl-thiophene-2-carboxylic acid Openeye Name: 5-[(4-bromo-3-methyl-anilino)methyl]-4-methyl-thiophene-2-carboxylic acid CAS Name: 5-[(4-bromo-3-methylanilino)methyl]-4-methyl-2-thiophenecarboxylic acid IUPAC Name: 5-[(4-bromo-3-methylanilino)methyl]-4-methylthiophene-2-carboxylic acid Traditional Name: 5-[(4-bromo-3-methyl-anilino)methyl]-4-methyl-2-thenoic acid Formula: C14H14BrNO2S MolecularWeight: 340.23546

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NCC2=C(C=C(S2)C(=O)O)C)Br

Isomeric SMILES

CC1=C(C=CC(=C1)NCC2=C(C=C(S2)C(=O)O)C)Br

InChI

InChI=1S/C14H14BrNO2S/c1-8-5-10(3-4-11(8)15)16-7-13-9(2)6-12(19-13)14(17)18/h3-6,16H,7H2,1-2H3,(H,17,18)