1,1-bis(oxidanylidene)-2-(2-quinolin-2-ylsulfanylethyl)-1,2-benzothiazol-3-one

Systemtic Name: 1,1-bis(oxidanylidene)-2-(2-quinolin-2-ylsulfanylethyl)-1,2-benzothiazol-3-one Openeye Name: 1,1-dioxo-2-[2-(2-quinolylsulfanyl)ethyl]-1,2-benzothiazol-3-one CAS Name: 1,1-dioxo-2-[2-(2-quinolinylthio)ethyl]-1,2-benzothiazol-3-one IUPAC Name: 1,1-dioxo-2-(2-quinolin-2-ylsulfanylethyl)-1,2-benzothiazol-3-one Traditional Name: 1,1-diketo-2-[2-(2-quinolylthio)ethyl]-1,2-benzothiazol-3-one Formula: C18H14N2O3S2 MolecularWeight: 370.44536

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC(=N2)SCCN3C(=O)C4=CC=CC=C4S3(=O)=O

Isomeric SMILES

C1=CC=C2C(=C1)C=CC(=N2)SCCN3C(=O)C4=CC=CC=C4S3(=O)=O

InChI

InChI=1S/C18H14N2O3S2/c21-18-14-6-2-4-8-16(14)25(22,23)20(18)11-12-24-17-10-9-13-5-1-3-7-15(13)19-17/h1-10H,11-12H2