3-[[4-(5,6-dihydro-4H-cyclopenta[b]thiophen-2-ylcarbonylamino)phenyl]sulfonylamino]propanoic acid

Systemtic Name: 3-[[4-(5,6-dihydro-4H-cyclopenta[b]thiophen-2-ylcarbonylamino)phenyl]sulfonylamino]propanoic acid Openeye Name: 3-[[4-(5,6-dihydro-4H-cyclopenta[b]thiophene-2-carbonylamino)phenyl]sulfonylamino]propanoic acid CAS Name: 3-[[4-[[5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl(oxo)methyl]amino]phenyl]sulfonylamino]propanoic acid IUPAC Name: 3-[[4-(5,6-dihydro-4H-cyclopenta[b]thiophene-2-carbonylamino)phenyl]sulfonylamino]propanoic acid Traditional Name: 3-[[4-(5,6-dihydro-4H-cyclopenta[b]thiophene-2-carbonylamino)phenyl]sulfonylamino]propionic acid Formula: C17H18N2O5S2 MolecularWeight: 394.46522

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C1)SC(=C2)C(=O)NC3=CC=C(C=C3)S(=O)(=O)NCCC(=O)O

Isomeric SMILES

C1CC2=C(C1)SC(=C2)C(=O)NC3=CC=C(C=C3)S(=O)(=O)NCCC(=O)O

InChI

InChI=1S/C17H18N2O5S2/c20-16(21)8-9-18-26(23,24)13-6-4-12(5-7-13)19-17(22)15-10-11-2-1-3-14(11)25-15/h4-7,10,18H,1-3,8-9H2,(H,19,22)(H,20,21)