2-[[2-[bis(propylsulfanyl)methyl]phenoxy]methyl]-1,3-benzothiazole

Systemtic Name: 2-[[2-[bis(propylsulfanyl)methyl]phenoxy]methyl]-1,3-benzothiazole Openeye Name: 2-[[2-[bis(propylsulfanyl)methyl]phenoxy]methyl]-1,3-benzothiazole CAS Name: 2-[[2-[bis(propylthio)methyl]phenoxy]methyl]-1,3-benzothiazole IUPAC Name: 2-[[2-[bis(propylsulfanyl)methyl]phenoxy]methyl]-1,3-benzothiazole Traditional Name: 2-[[2-[bis(propylthio)methyl]phenoxy]methyl]-1,3-benzothiazole Formula: C21H25NOS3 MolecularWeight: 403.6243

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCSC(C1=CC=CC=C1OCC2=NC3=CC=CC=C3S2)SCCC

Isomeric SMILES

CCCSC(C1=CC=CC=C1OCC2=NC3=CC=CC=C3S2)SCCC

InChI

InChI=1S/C21H25NOS3/c1-3-13-24-21(25-14-4-2)16-9-5-7-11-18(16)23-15-20-22-17-10-6-8-12-19(17)26-20/h5-12,21H,3-4,13-15H2,1-2H3