2-[2-[[3-(methylsulfanylmethyl)phenyl]carbonylamino]-1,3-thiazol-4-yl]ethanoic acid

Systemtic Name: 2-[2-[[3-(methylsulfanylmethyl)phenyl]carbonylamino]-1,3-thiazol-4-yl]ethanoic acid Openeye Name: 2-[2-[[3-(methylsulfanylmethyl)benzoyl]amino]thiazol-4-yl]acetic acid CAS Name: 2-[2-[[[3-[(methylthio)methyl]phenyl]-oxomethyl]amino]-4-thiazolyl]acetic acid IUPAC Name: 2-[2-[[3-(methylsulfanylmethyl)benzoyl]amino]-1,3-thiazol-4-yl]acetic acid Traditional Name: 2-[2-[[3-[(methylthio)methyl]benzoyl]amino]thiazol-4-yl]acetic acid Formula: C14H14N2O3S2 MolecularWeight: 322.40256

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSCC1=CC=CC(=C1)C(=O)NC2=NC(=CS2)CC(=O)O

Isomeric SMILES

CSCC1=CC=CC(=C1)C(=O)NC2=NC(=CS2)CC(=O)O

InChI

InChI=1S/C14H14N2O3S2/c1-20-7-9-3-2-4-10(5-9)13(19)16-14-15-11(8-21-14)6-12(17)18/h2-5,8H,6-7H2,1H3,(H,17,18)(H,15,16,19)