3-[(6-chloranyl-3-methyl-2-sulfanylidene-1H-benzimidazol-5-yl)sulfanyl]propanoic acid

Systemtic Name: 3-[(6-chloranyl-3-methyl-2-sulfanylidene-1H-benzimidazol-5-yl)sulfanyl]propanoic acid Openeye Name: 3-[(6-chloro-3-methyl-2-thioxo-1H-benzimidazol-5-yl)sulfanyl]propanoic acid CAS Name: 3-[(6-chloro-3-methyl-2-sulfanylidene-1H-benzimidazol-5-yl)thio]propanoic acid IUPAC Name: 3-[(6-chloro-3-methyl-2-sulfanylidene-1H-benzimidazol-5-yl)sulfanyl]propanoic acid Traditional Name: 3-[(6-chloro-3-methyl-2-thioxo-1H-benzimidazol-5-yl)thio]propionic acid Formula: C11H11ClN2O2S2 MolecularWeight: 302.80024

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC(=C(C=C2NC1=S)Cl)SCCC(=O)O

Isomeric SMILES

CN1C2=CC(=C(C=C2NC1=S)Cl)SCCC(=O)O

InChI

InChI=1S/C11H11ClN2O2S2/c1-14-8-5-9(18-3-2-10(15)16)6(12)4-7(8)13-11(14)17/h4-5H,2-3H2,1H3,(H,13,17)(H,15,16)