1,3-benzothiazol-3-ium; (E)-1-chloranylprop-1-ene

Systemtic Name: 1,3-benzothiazol-3-ium; (E)-1-chloranylprop-1-ene Openeye Name: 1,3-benzothiazol-3-ium; (E)-1-chloroprop-1-ene CAS Name: 1,3-benzothiazol-3-ium; (E)-1-chloro-1-propene IUPAC Name: 1,3-benzothiazol-3-ium; (E)-1-chloroprop-1-ene Traditional Name: 1,3-benzothiazol-3-ium; (E)-1-chloroprop-1-ene Formula: C10H11ClNS+ MolecularWeight: 212.71904

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Descriptors Computed from Structure

Canonical SMILES:

CC=CCl.C1=CC=C2C(=C1)[NH+]=CS2

Isomeric SMILES

C/C=C/Cl.C1=CC=C2C(=C1)[NH+]=CS2

InChI

InChI=1S/C7H5NS.C3H5Cl/c1-2-4-7-6(3-1)8-5-9-7;1-2-3-4/h1-5H;2-3H,1H3/p+1/b;3-2+