1-(1,3-benzothiazol-2-yl)-3-trioctoxysilyl-propane-1,1-dithiol

Systemtic Name: 1-(1,3-benzothiazol-2-yl)-3-trioctoxysilyl-propane-1,1-dithiol Openeye Name: 1-(1,3-benzothiazol-2-yl)-3-trioctoxysilyl-propane-1,1-dithiol CAS Name: 1-(1,3-benzothiazol-2-yl)-3-trioctoxysilylpropane-1,1-dithiol IUPAC Name: 1-(1,3-benzothiazol-2-yl)-3-trioctoxysilylpropane-1,1-dithiol Traditional Name: 1-(1,3-benzothiazol-2-yl)-3-trioctoxysilyl-propane-1,1-dithiol Formula: C34H61NO3S3Si MolecularWeight: 656.13354

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCO[Si](CCC(C1=NC2=CC=CC=C2S1)(S)S)(OCCCCCCCC)OCCCCCCCC

Isomeric SMILES

CCCCCCCCO[Si](CCC(C1=NC2=CC=CC=C2S1)(S)S)(OCCCCCCCC)OCCCCCCCC

InChI

InChI=1S/C34H61NO3S3Si/c1-4-7-10-13-16-21-27-36-42(37-28-22-17-14-11-8-5-2,38-29-23-18-15-12-9-6-3)30-26-34(39,40)33-35-31-24-19-20-25-32(31)41-33/h19-20,24-25,39-40H,4-18,21-23,26-30H2,1-3H3