3-[(3-methylthiophen-2-yl)methylamino]-3-thiophen-2-yl-propanoic acid

Systemtic Name: 3-[(3-methylthiophen-2-yl)methylamino]-3-thiophen-2-yl-propanoic acid Openeye Name: 3-[(3-methyl-2-thienyl)methylamino]-3-(2-thienyl)propanoic acid CAS Name: 3-[(3-methyl-2-thiophenyl)methylamino]-3-thiophen-2-ylpropanoic acid IUPAC Name: 3-[(3-methylthiophen-2-yl)methylamino]-3-thiophen-2-ylpropanoic acid Traditional Name: 3-[(3-methyl-2-thienyl)methylamino]-3-(2-thienyl)propionic acid Formula: C13H15NO2S2 MolecularWeight: 281.3937

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)CNC(CC(=O)O)C2=CC=CS2

Isomeric SMILES

CC1=C(SC=C1)CNC(CC(=O)O)C2=CC=CS2

InChI

InChI=1S/C13H15NO2S2/c1-9-4-6-18-12(9)8-14-10(7-13(15)16)11-3-2-5-17-11/h2-6,10,14H,7-8H2,1H3,(H,15,16)