2-[(5-chloranyl-1,3-benzothiazol-2-yl)sulfanyl]-1-(1H-pyrrol-2-yl)ethanone

Systemtic Name: 2-[(5-chloranyl-1,3-benzothiazol-2-yl)sulfanyl]-1-(1H-pyrrol-2-yl)ethanone Openeye Name: 2-[(5-chloro-1,3-benzothiazol-2-yl)sulfanyl]-1-(1H-pyrrol-2-yl)ethanone CAS Name: 2-[(5-chloro-1,3-benzothiazol-2-yl)thio]-1-(1H-pyrrol-2-yl)ethanone IUPAC Name: 2-[(5-chloro-1,3-benzothiazol-2-yl)sulfanyl]-1-(1H-pyrrol-2-yl)ethanone Traditional Name: 2-[(5-chloro-1,3-benzothiazol-2-yl)thio]-1-(1H-pyrrol-2-yl)ethanone Formula: C13H9ClN2OS2 MolecularWeight: 308.80636

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Descriptors Computed from Structure

Canonical SMILES:

C1=CNC(=C1)C(=O)CSC2=NC3=C(S2)C=CC(=C3)Cl

Isomeric SMILES

C1=CNC(=C1)C(=O)CSC2=NC3=C(S2)C=CC(=C3)Cl

InChI

InChI=1S/C13H9ClN2OS2/c14-8-3-4-12-10(6-8)16-13(19-12)18-7-11(17)9-2-1-5-15-9/h1-6,15H,7H2