3-(thian-4-ylamino)-3-thiophen-2-yl-propanoic acid

Systemtic Name: 3-(thian-4-ylamino)-3-thiophen-2-yl-propanoic acid Openeye Name: 3-(tetrahydrothiopyran-4-ylamino)-3-(2-thienyl)propanoic acid CAS Name: 3-(4-thianylamino)-3-thiophen-2-ylpropanoic acid IUPAC Name: 3-(thian-4-ylamino)-3-thiophen-2-ylpropanoic acid Traditional Name: 3-(tetrahydrothiopyran-4-ylamino)-3-(2-thienyl)propionic acid Formula: C12H17NO2S2 MolecularWeight: 271.39888

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Descriptors Computed from Structure

Canonical SMILES:

C1CSCCC1NC(CC(=O)O)C2=CC=CS2

Isomeric SMILES

C1CSCCC1NC(CC(=O)O)C2=CC=CS2

InChI

InChI=1S/C12H17NO2S2/c14-12(15)8-10(11-2-1-5-17-11)13-9-3-6-16-7-4-9/h1-2,5,9-10,13H,3-4,6-8H2,(H,14,15)