3-[(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)sulfamoyl]propanoic acid

Systemtic Name: 3-[(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)sulfamoyl]propanoic acid Openeye Name: 3-[(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)sulfamoyl]propanoic acid CAS Name: 3-[(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)sulfamoyl]propanoic acid IUPAC Name: 3-[(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)sulfamoyl]propanoic acid Traditional Name: 3-[(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)sulfamoyl]propionic acid Formula: C13H16N2O4S2 MolecularWeight: 328.40714

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(CC1)SC(=C2C#N)NS(=O)(=O)CCC(=O)O

Isomeric SMILES

C1CCC2=C(CC1)SC(=C2C#N)NS(=O)(=O)CCC(=O)O

InChI

InChI=1S/C13H16N2O4S2/c14-8-10-9-4-2-1-3-5-11(9)20-13(10)15-21(18,19)7-6-12(16)17/h15H,1-7H2,(H,16,17)