2-[[2-[(3,4-dimethoxyphenyl)sulfonylamino]-3-thiophen-2-yl-propanoyl]amino]hexanoic acid

Systemtic Name: 2-[[2-[(3,4-dimethoxyphenyl)sulfonylamino]-3-thiophen-2-yl-propanoyl]amino]hexanoic acid Openeye Name: 2-[[2-[(3,4-dimethoxyphenyl)sulfonylamino]-3-(2-thienyl)propanoyl]amino]hexanoic acid CAS Name: 2-[[2-[(3,4-dimethoxyphenyl)sulfonylamino]-1-oxo-3-thiophen-2-ylpropyl]amino]hexanoic acid IUPAC Name: 2-[[2-[(3,4-dimethoxyphenyl)sulfonylamino]-3-thiophen-2-ylpropanoyl]amino]hexanoic acid Traditional Name: 2-[[2-[(3,4-dimethoxyphenyl)sulfonylamino]-3-(2-thienyl)propanoyl]amino]hexanoic acid Formula: C21H28N2O7S2 MolecularWeight: 484.58622

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)O)NC(=O)C(CC1=CC=CS1)NS(=O)(=O)C2=CC(=C(C=C2)OC)OC

Isomeric SMILES

CCCCC(C(=O)O)NC(=O)C(CC1=CC=CS1)NS(=O)(=O)C2=CC(=C(C=C2)OC)OC

InChI

InChI=1S/C21H28N2O7S2/c1-4-5-8-16(21(25)26)22-20(24)17(12-14-7-6-11-31-14)23-32(27,28)15-9-10-18(29-2)19(13-15)30-3/h6-7,9-11,13,16-17,23H,4-5,8,12H2,1-3H3,(H,22,24)(H,25,26)