2-azanyl-6-(1,3-benzodioxol-5-yloxy)hexane-1-thiol

Systemtic Name: 2-azanyl-6-(1,3-benzodioxol-5-yloxy)hexane-1-thiol Openeye Name: 2-amino-6-(1,3-benzodioxol-5-yloxy)hexane-1-thiol CAS Name: 2-amino-6-(1,3-benzodioxol-5-yloxy)-1-hexanethiol IUPAC Name: 2-amino-6-(1,3-benzodioxol-5-yloxy)hexane-1-thiol Traditional Name: 2-amino-6-(1,3-benzodioxol-5-yloxy)hexane-1-thiol Formula: C13H19NO3S MolecularWeight: 269.35986

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)OCCCCC(CS)N

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)OCCCCC(CS)N

InChI

InChI=1S/C13H19NO3S/c14-10(8-18)3-1-2-6-15-11-4-5-12-13(7-11)17-9-16-12/h4-5,7,10,18H,1-3,6,8-9,14H2