2-[3-(phenylmethyl)-2-sulfanylidene-1,3-thiazol-4-yl]ethanoic acid

Systemtic Name: 2-[3-(phenylmethyl)-2-sulfanylidene-1,3-thiazol-4-yl]ethanoic acid Openeye Name: 2-(3-benzyl-2-thioxo-thiazol-4-yl)acetic acid CAS Name: 2-[3-(phenylmethyl)-2-sulfanylidene-4-thiazolyl]acetic acid IUPAC Name: 2-(3-benzyl-2-sulfanylidene-1,3-thiazol-4-yl)acetic acid Traditional Name: 2-(3-benzyl-2-thioxo-4-thiazolin-4-yl)acetic acid Formula: C12H11NO2S2 MolecularWeight: 265.35124

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C(=CSC2=S)CC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CN2C(=CSC2=S)CC(=O)O

InChI

InChI=1S/C12H11NO2S2/c14-11(15)6-10-8-17-12(16)13(10)7-9-4-2-1-3-5-9/h1-5,8H,6-7H2,(H,14,15)