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3-prop-2-ynyl-1,3-benzothiazol-3-ium

3-prop-2-ynyl-1,3-benzothiazol-3-ium

Systemtic Name:3-prop-2-ynyl-1,3-benzothiazol-3-ium
Openeye Name:3-prop-2-ynyl-1,3-benzothiazol-3-ium
CAS Name:3-prop-2-ynyl-1,3-benzothiazol-3-ium
IUPAC Name:3-prop-2-ynyl-1,3-benzothiazol-3-ium
Traditional Name:3-propargyl-1,3-benzothiazol-3-ium
Formula: C10H8NS+
MolecularWeight: 174.24222
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Descriptors Computed from Structure

Canonical SMILES:

C#CC[N+]1=CSC2=CC=CC=C21


Isomeric SMILES

C#CC[N+]1=CSC2=CC=CC=C21


InChI

InChI=1S/C10H8NS/c1-2-7-11-8-12-10-6-4-3-5-9(10)11/h1,3-6,8H,7H2/q+1


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