3-[(5-chloranyl-1,3-benzothiazol-2-yl)sulfanylmethyl]benzenecarbonitrile

Systemtic Name: 3-[(5-chloranyl-1,3-benzothiazol-2-yl)sulfanylmethyl]benzenecarbonitrile Openeye Name: 3-[(5-chloro-1,3-benzothiazol-2-yl)sulfanylmethyl]benzonitrile CAS Name: 3-[[(5-chloro-1,3-benzothiazol-2-yl)thio]methyl]benzonitrile IUPAC Name: 3-[(5-chloro-1,3-benzothiazol-2-yl)sulfanylmethyl]benzonitrile Traditional Name: 3-[[(5-chloro-1,3-benzothiazol-2-yl)thio]methyl]benzonitrile Formula: C15H9ClN2S2 MolecularWeight: 316.82836

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)CSC2=NC3=C(S2)C=CC(=C3)Cl)C#N

Isomeric SMILES

C1=CC(=CC(=C1)CSC2=NC3=C(S2)C=CC(=C3)Cl)C#N

InChI

InChI=1S/C15H9ClN2S2/c16-12-4-5-14-13(7-12)18-15(20-14)19-9-11-3-1-2-10(6-11)8-17/h1-7H,9H2