2-(5-chloranyl-1-propyl-benzimidazol-2-yl)sulfanylethanoic acid

Systemtic Name: 2-(5-chloranyl-1-propyl-benzimidazol-2-yl)sulfanylethanoic acid Openeye Name: 2-(5-chloro-1-propyl-benzimidazol-2-yl)sulfanylacetic acid CAS Name: 2-[(5-chloro-1-propyl-2-benzimidazolyl)thio]acetic acid IUPAC Name: 2-(5-chloro-1-propylbenzimidazol-2-yl)sulfanylacetic acid Traditional Name: 2-[(5-chloro-1-propyl-benzimidazol-2-yl)thio]acetic acid Formula: C12H13ClN2O2S MolecularWeight: 284.76182

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C=C(C=C2)Cl)N=C1SCC(=O)O

Isomeric SMILES

CCCN1C2=C(C=C(C=C2)Cl)N=C1SCC(=O)O

InChI

InChI=1S/C12H13ClN2O2S/c1-2-5-15-10-4-3-8(13)6-9(10)14-12(15)18-7-11(16)17/h3-4,6H,2,5,7H2,1H3,(H,16,17)