2-(5-tert-butylsulfanylpentylsulfanyl)-1,3-benzothiazole

Systemtic Name: 2-(5-tert-butylsulfanylpentylsulfanyl)-1,3-benzothiazole Openeye Name: 2-(5-tert-butylsulfanylpentylsulfanyl)-1,3-benzothiazole CAS Name: 2-[5-(tert-butylthio)pentylthio]-1,3-benzothiazole IUPAC Name: 2-(5-tert-butylsulfanylpentylsulfanyl)-1,3-benzothiazole Traditional Name: 2-[5-(tert-butylthio)pentylthio]-1,3-benzothiazole Formula: C16H23NS3 MolecularWeight: 325.55552

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)SCCCCCSC1=NC2=CC=CC=C2S1

Isomeric SMILES

CC(C)(C)SCCCCCSC1=NC2=CC=CC=C2S1

InChI

InChI=1S/C16H23NS3/c1-16(2,3)19-12-8-4-7-11-18-15-17-13-9-5-6-10-14(13)20-15/h5-6,9-10H,4,7-8,11-12H2,1-3H3