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

Systemtic Name: 2-[2-[(1S)-1-(azepan-1-yl)ethyl]-1,3-thiazol-4-yl]ethanoic acid Openeye Name: 2-[2-[(1S)-1-(azepan-1-yl)ethyl]thiazol-4-yl]acetic acid CAS Name: 2-[2-[(1S)-1-(1-azepanyl)ethyl]-4-thiazolyl]acetic acid IUPAC Name: 2-[2-[(1S)-1-(azepan-1-yl)ethyl]-1,3-thiazol-4-yl]acetic acid Traditional Name: 2-[2-[(1S)-1-(azepan-1-yl)ethyl]thiazol-4-yl]acetic acid Formula: C13H20N2O2S MolecularWeight: 268.3751

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC(=CS1)CC(=O)O)N2CCCCCC2

Isomeric SMILES

C[C@@H](C1=NC(=CS1)CC(=O)O)N2CCCCCC2

InChI

InChI=1S/C13H20N2O2S/c1-10(15-6-4-2-3-5-7-15)13-14-11(9-18-13)8-12(16)17/h9-10H,2-8H2,1H3,(H,16,17)/t10-/m0/s1