2-[2-[(4,5-dimethyl-1,3-thiazol-2-yl)amino]-2-oxidanylidene-ethyl]sulfanylbenzoate

Systemtic Name: 2-[2-[(4,5-dimethyl-1,3-thiazol-2-yl)amino]-2-oxidanylidene-ethyl]sulfanylbenzoate Openeye Name: 2-[2-[(4,5-dimethylthiazol-2-yl)amino]-2-oxo-ethyl]sulfanylbenzoate CAS Name: 2-[[2-[(4,5-dimethyl-2-thiazolyl)amino]-2-oxoethyl]thio]benzoate IUPAC Name: 2-[2-[(4,5-dimethyl-1,3-thiazol-2-yl)amino]-2-oxoethyl]sulfanylbenzoate Traditional Name: 2-[[2-[(4,5-dimethylthiazol-2-yl)amino]-2-keto-ethyl]thio]benzoate Formula: C14H13N2O3S2- MolecularWeight: 321.39462

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)NC(=O)CSC2=CC=CC=C2C(=O)[O-])C

Isomeric SMILES

CC1=C(SC(=N1)NC(=O)CSC2=CC=CC=C2C(=O)[O-])C

InChI

InChI=1S/C14H14N2O3S2/c1-8-9(2)21-14(15-8)16-12(17)7-20-11-6-4-3-5-10(11)13(18)19/h3-6H,7H2,1-2H3,(H,18,19)(H,15,16,17)/p-1