S-(5-bromanylpentyl) 1H-benzimidazole-2-carbothioate

Systemtic Name: S-(5-bromanylpentyl) 1H-benzimidazole-2-carbothioate Openeye Name: S-(5-bromopentyl) 1H-benzimidazole-2-carbothioate CAS Name: 1H-benzimidazole-2-carbothioic acid S-(5-bromopentyl) ester IUPAC Name: S-(5-bromopentyl) 1H-benzimidazole-2-carbothioate Traditional Name: 1H-benzimidazole-2-carbothioic acid S-(5-bromopentyl) ester Formula: C13H15BrN2OS MolecularWeight: 327.24

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=N2)C(=O)SCCCCCBr

Isomeric SMILES

C1=CC=C2C(=C1)NC(=N2)C(=O)SCCCCCBr

InChI

InChI=1S/C13H15BrN2OS/c14-8-4-1-5-9-18-13(17)12-15-10-6-2-3-7-11(10)16-12/h2-3,6-7H,1,4-5,8-9H2,(H,15,16)