2-[1,3-benzothiazol-2-yl(cyclopropylmethyl)amino]ethanoic acid

Systemtic Name: 2-[1,3-benzothiazol-2-yl(cyclopropylmethyl)amino]ethanoic acid Openeye Name: 2-[1,3-benzothiazol-2-yl(cyclopropylmethyl)amino]acetic acid CAS Name: 2-[1,3-benzothiazol-2-yl(cyclopropylmethyl)amino]acetic acid IUPAC Name: 2-[1,3-benzothiazol-2-yl(cyclopropylmethyl)amino]acetic acid Traditional Name: 2-[1,3-benzothiazol-2-yl(cyclopropylmethyl)amino]acetic acid Formula: C13H14N2O2S MolecularWeight: 262.32746

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC1CN(CC(=O)O)C2=NC3=CC=CC=C3S2

Isomeric SMILES

C1CC1CN(CC(=O)O)C2=NC3=CC=CC=C3S2

InChI

InChI=1S/C13H14N2O2S/c16-12(17)8-15(7-9-5-6-9)13-14-10-3-1-2-4-11(10)18-13/h1-4,9H,5-8H2,(H,16,17)