N-[2-oxidanylidene-2-[[2-(2-propan-2-ylsulfanylethylsulfanyl)-1,3-benzothiazol-6-yl]amino]ethoxy]benzamide

Systemtic Name: N-[2-oxidanylidene-2-[[2-(2-propan-2-ylsulfanylethylsulfanyl)-1,3-benzothiazol-6-yl]amino]ethoxy]benzamide Openeye Name: N-[2-[[2-(2-isopropylsulfanylethylsulfanyl)-1,3-benzothiazol-6-yl]amino]-2-oxo-ethoxy]benzamide CAS Name: N-[2-oxo-2-[[2-[2-(propan-2-ylthio)ethylthio]-1,3-benzothiazol-6-yl]amino]ethoxy]benzamide IUPAC Name: N-[2-oxo-2-[[2-(2-propan-2-ylsulfanylethylsulfanyl)-1,3-benzothiazol-6-yl]amino]ethoxy]benzamide Traditional Name: N-[2-[[2-[2-(isopropylthio)ethylthio]-1,3-benzothiazol-6-yl]amino]-2-keto-ethoxy]benzamide Formula: C21H23N3O3S3 MolecularWeight: 461.62062

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)SCCSC1=NC2=C(S1)C=C(C=C2)NC(=O)CONC(=O)C3=CC=CC=C3

Isomeric SMILES

CC(C)SCCSC1=NC2=C(S1)C=C(C=C2)NC(=O)CONC(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H23N3O3S3/c1-14(2)28-10-11-29-21-23-17-9-8-16(12-18(17)30-21)22-19(25)13-27-24-20(26)15-6-4-3-5-7-15/h3-9,12,14H,10-11,13H2,1-2H3,(H,22,25)(H,24,26)