1-methyl-2-methylsulfanyl-5-[(E)-2-phenylethenyl]imidazole-4-carboxylic acid

Systemtic Name: 1-methyl-2-methylsulfanyl-5-[(E)-2-phenylethenyl]imidazole-4-carboxylic acid Openeye Name: 1-methyl-2-methylsulfanyl-5-[(E)-styryl]imidazole-4-carboxylic acid CAS Name: 1-methyl-2-(methylthio)-5-[(E)-2-phenylethenyl]-4-imidazolecarboxylic acid IUPAC Name: 1-methyl-2-methylsulfanyl-5-[(E)-2-phenylethenyl]imidazole-4-carboxylic acid Traditional Name: 1-methyl-2-(methylthio)-5-[(E)-styryl]imidazole-4-carboxylic acid Formula: C14H14N2O2S MolecularWeight: 274.33816

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(N=C1SC)C(=O)O)C=CC2=CC=CC=C2

Isomeric SMILES

CN1C(=C(N=C1SC)C(=O)O)/C=C/C2=CC=CC=C2

InChI

InChI=1S/C14H14N2O2S/c1-16-11(9-8-10-6-4-3-5-7-10)12(13(17)18)15-14(16)19-2/h3-9H,1-2H3,(H,17,18)/b9-8+