2-[2-(azepan-1-ylsulfonylamino)-1,3-thiazol-4-yl]ethanoic acid

Systemtic Name: 2-[2-(azepan-1-ylsulfonylamino)-1,3-thiazol-4-yl]ethanoic acid Openeye Name: 2-[2-(azepan-1-ylsulfonylamino)thiazol-4-yl]acetic acid CAS Name: 2-[2-(1-azepanylsulfonylamino)-4-thiazolyl]acetic acid IUPAC Name: 2-[2-(azepan-1-ylsulfonylamino)-1,3-thiazol-4-yl]acetic acid Traditional Name: 2-[2-(azepan-1-ylsulfonylamino)thiazol-4-yl]acetic acid Formula: C11H17N3O4S2 MolecularWeight: 319.40038

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)NC2=NC(=CS2)CC(=O)O

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)NC2=NC(=CS2)CC(=O)O

InChI

InChI=1S/C11H17N3O4S2/c15-10(16)7-9-8-19-11(12-9)13-20(17,18)14-5-3-1-2-4-6-14/h8H,1-7H2,(H,12,13)(H,15,16)