3-[3-[2-(thiophen-2-ylsulfonylamino)ethyl]indol-1-yl]propanoic acid

Systemtic Name: 3-[3-[2-(thiophen-2-ylsulfonylamino)ethyl]indol-1-yl]propanoic acid Openeye Name: 3-[3-[2-(2-thienylsulfonylamino)ethyl]indol-1-yl]propanoic acid CAS Name: 3-[3-[2-(thiophen-2-ylsulfonylamino)ethyl]-1-indolyl]propanoic acid IUPAC Name: 3-[3-[2-(thiophen-2-ylsulfonylamino)ethyl]indol-1-yl]propanoic acid Traditional Name: 3-[3-[2-(2-thienylsulfonylamino)ethyl]indol-1-yl]propionic acid Formula: C17H18N2O4S2 MolecularWeight: 378.46582

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2CCC(=O)O)CCNS(=O)(=O)C3=CC=CS3

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2CCC(=O)O)CCNS(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C17H18N2O4S2/c20-16(21)8-10-19-12-13(14-4-1-2-5-15(14)19)7-9-18-25(22,23)17-6-3-11-24-17/h1-6,11-12,18H,7-10H2,(H,20,21)