(E)-4-(4-imidazol-1-ylthiophen-2-yl)but-3-enoic acid

Systemtic Name: (E)-4-(4-imidazol-1-ylthiophen-2-yl)but-3-enoic acid Openeye Name: (E)-4-(4-imidazol-1-yl-2-thienyl)but-3-enoic acid CAS Name: (E)-4-[4-(1-imidazolyl)-2-thiophenyl]-3-butenoic acid IUPAC Name: (E)-4-(4-imidazol-1-ylthiophen-2-yl)but-3-enoic acid Traditional Name: (E)-4-(4-imidazol-1-yl-2-thienyl)but-3-enoic acid Formula: C11H10N2O2S MolecularWeight: 234.2743

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN(C=N1)C2=CSC(=C2)C=CCC(=O)O

Isomeric SMILES

C1=CN(C=N1)C2=CSC(=C2)/C=C/CC(=O)O

InChI

InChI=1S/C11H10N2O2S/c14-11(15)3-1-2-10-6-9(7-16-10)13-5-4-12-8-13/h1-2,4-8H,3H2,(H,14,15)/b2-1+