(E)-2-(1H-imidazol-5-yl)-3-methyl-4-thiophen-3-yl-but-2-enoic acid

Systemtic Name: (E)-2-(1H-imidazol-5-yl)-3-methyl-4-thiophen-3-yl-but-2-enoic acid Openeye Name: (E)-2-(1H-imidazol-5-yl)-3-methyl-4-(3-thienyl)but-2-enoic acid CAS Name: (E)-2-(1H-imidazol-5-yl)-3-methyl-4-(3-thiophenyl)-2-butenoic acid IUPAC Name: (E)-2-(1H-imidazol-5-yl)-3-methyl-4-thiophen-3-ylbut-2-enoic acid Traditional Name: (E)-2-(1H-imidazol-5-yl)-3-methyl-4-(3-thienyl)but-2-enoic acid Formula: C12H12N2O2S MolecularWeight: 248.30088

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C(C1=CN=CN1)C(=O)O)CC2=CSC=C2

Isomeric SMILES

C/C(=C(/C1=CN=CN1)\C(=O)O)/CC2=CSC=C2

InChI

InChI=1S/C12H12N2O2S/c1-8(4-9-2-3-17-6-9)11(12(15)16)10-5-13-7-14-10/h2-3,5-7H,4H2,1H3,(H,13,14)(H,15,16)/b11-8+