S-[2-oxidanylidene-2-[(4-propan-2-yl-1,3-benzothiazol-2-yl)amino]ethyl] ethanethioate

Systemtic Name: S-[2-oxidanylidene-2-[(4-propan-2-yl-1,3-benzothiazol-2-yl)amino]ethyl] ethanethioate Openeye Name: S-[2-[(4-isopropyl-1,3-benzothiazol-2-yl)amino]-2-oxo-ethyl] ethanethioate CAS Name: ethanethioic acid S-[2-oxo-2-[(4-propan-2-yl-1,3-benzothiazol-2-yl)amino]ethyl] ester IUPAC Name: S-[2-oxo-2-[(4-propan-2-yl-1,3-benzothiazol-2-yl)amino]ethyl] ethanethioate Traditional Name: ethanethioic acid S-[2-[(4-isopropyl-1,3-benzothiazol-2-yl)amino]-2-keto-ethyl] ester Formula: C14H16N2O2S2 MolecularWeight: 308.41904

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C2C(=CC=C1)SC(=N2)NC(=O)CSC(=O)C

Isomeric SMILES

CC(C)C1=C2C(=CC=C1)SC(=N2)NC(=O)CSC(=O)C

InChI

InChI=1S/C14H16N2O2S2/c1-8(2)10-5-4-6-11-13(10)16-14(20-11)15-12(18)7-19-9(3)17/h4-6,8H,7H2,1-3H3,(H,15,16,18)