2-(2-pyridin-2-ylsulfanylethylsulfonyl)-1,3-benzothiazole

Systemtic Name: 2-(2-pyridin-2-ylsulfanylethylsulfonyl)-1,3-benzothiazole Openeye Name: 2-[2-(2-pyridylsulfanyl)ethylsulfonyl]-1,3-benzothiazole CAS Name: 2-[2-(2-pyridinylthio)ethylsulfonyl]-1,3-benzothiazole IUPAC Name: 2-(2-pyridin-2-ylsulfanylethylsulfonyl)-1,3-benzothiazole Traditional Name: 2-[2-(2-pyridylthio)ethylsulfonyl]-1,3-benzothiazole Formula: C14H12N2O2S3 MolecularWeight: 336.45228

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)S(=O)(=O)CCSC3=CC=CC=N3

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)S(=O)(=O)CCSC3=CC=CC=N3

InChI

InChI=1S/C14H12N2O2S3/c17-21(18,10-9-19-13-7-3-4-8-15-13)14-16-11-5-1-2-6-12(11)20-14/h1-8H,9-10H2