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

Systemtic Name: S-[2-[[3-(1,3-benzothiazol-2-yl)phenyl]amino]-2-oxidanylidene-ethyl] ethanethioate Openeye Name: S-[2-[3-(1,3-benzothiazol-2-yl)anilino]-2-oxo-ethyl] ethanethioate CAS Name: ethanethioic acid S-[2-[3-(1,3-benzothiazol-2-yl)anilino]-2-oxoethyl] ester IUPAC Name: S-[2-[3-(1,3-benzothiazol-2-yl)anilino]-2-oxoethyl] ethanethioate Traditional Name: ethanethioic acid S-[2-[3-(1,3-benzothiazol-2-yl)anilino]-2-keto-ethyl] ester Formula: C17H14N2O2S2 MolecularWeight: 342.43526

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SCC(=O)NC1=CC=CC(=C1)C2=NC3=CC=CC=C3S2

Isomeric SMILES

CC(=O)SCC(=O)NC1=CC=CC(=C1)C2=NC3=CC=CC=C3S2

InChI

InChI=1S/C17H14N2O2S2/c1-11(20)22-10-16(21)18-13-6-4-5-12(9-13)17-19-14-7-2-3-8-15(14)23-17/h2-9H,10H2,1H3,(H,18,21)