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1,3-benzothiazol-2-ylsulfanylmethyl thiocyanate

1,3-benzothiazol-2-ylsulfanylmethyl thiocyanate

Systemtic Name:1,3-benzothiazol-2-ylsulfanylmethyl thiocyanate
Openeye Name:1,3-benzothiazol-2-ylsulfanylmethyl thiocyanate
CAS Name:thiocyanic acid (1,3-benzothiazol-2-ylthio)methyl ester
IUPAC Name:1,3-benzothiazol-2-ylsulfanylmethyl thiocyanate
Traditional Name:thiocyanic acid (1,3-benzothiazol-2-ylthio)methyl ester
Formula: C9H6N2S3
MolecularWeight: 238.35234
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)SCSC#N


Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)SCSC#N


InChI

InChI=1S/C9H6N2S3/c10-5-12-6-13-9-11-7-3-1-2-4-8(7)14-9/h1-4H,6H2


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