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

Systemtic Name: (E)-3-(1H-imidazol-5-yl)-2-(thiophen-2-ylmethyl)but-2-enoic acid Openeye Name: (E)-3-(1H-imidazol-5-yl)-2-(2-thienylmethyl)but-2-enoic acid CAS Name: (E)-3-(1H-imidazol-5-yl)-2-(thiophen-2-ylmethyl)-2-butenoic acid IUPAC Name: (E)-3-(1H-imidazol-5-yl)-2-(thiophen-2-ylmethyl)but-2-enoic acid Traditional Name: (E)-3-(1H-imidazol-5-yl)-2-(2-thenyl)but-2-enoic acid Formula: C12H12N2O2S MolecularWeight: 248.30088

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C(CC1=CC=CS1)C(=O)O)C2=CN=CN2

Isomeric SMILES

C/C(=C(/CC1=CC=CS1)\C(=O)O)/C2=CN=CN2

InChI

InChI=1S/C12H12N2O2S/c1-8(11-6-13-7-14-11)10(12(15)16)5-9-3-2-4-17-9/h2-4,6-7H,5H2,1H3,(H,13,14)(H,15,16)/b10-8+