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2-heptylsulfanyl-1,3-benzothiazole

2-heptylsulfanyl-1,3-benzothiazole

Systemtic Name:2-heptylsulfanyl-1,3-benzothiazole
Openeye Name:2-heptylsulfanyl-1,3-benzothiazole
CAS Name:2-(heptylthio)-1,3-benzothiazole
IUPAC Name:2-heptylsulfanyl-1,3-benzothiazole
Traditional Name:2-(heptylthio)-1,3-benzothiazole
Formula: C14H19NS2
MolecularWeight: 265.43736
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCSC1=NC2=CC=CC=C2S1


Isomeric SMILES

CCCCCCCSC1=NC2=CC=CC=C2S1


InChI

InChI=1S/C14H19NS2/c1-2-3-4-5-8-11-16-14-15-12-9-6-7-10-13(12)17-14/h6-7,9-10H,2-5,8,11H2,1H3


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