3-[[5-[2-(4-methylphenyl)ethynyl]thiophen-2-yl]sulfonylamino]propanoic acid

Systemtic Name: 3-[[5-[2-(4-methylphenyl)ethynyl]thiophen-2-yl]sulfonylamino]propanoic acid Openeye Name: 3-[[5-[2-(p-tolyl)ethynyl]-2-thienyl]sulfonylamino]propanoic acid CAS Name: 3-[[5-[2-(4-methylphenyl)ethynyl]-2-thiophenyl]sulfonylamino]propanoic acid IUPAC Name: 3-[[5-[2-(4-methylphenyl)ethynyl]thiophen-2-yl]sulfonylamino]propanoic acid Traditional Name: 3-[[5-[2-(p-tolyl)ethynyl]-2-thienyl]sulfonylamino]propionic acid Formula: C16H15NO4S2 MolecularWeight: 349.4246

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C#CC2=CC=C(S2)S(=O)(=O)NCCC(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)C#CC2=CC=C(S2)S(=O)(=O)NCCC(=O)O

InChI

InChI=1S/C16H15NO4S2/c1-12-2-4-13(5-3-12)6-7-14-8-9-16(22-14)23(20,21)17-11-10-15(18)19/h2-5,8-9,17H,10-11H2,1H3,(H,18,19)