3-(5-chloranyl-2-sulfanylidene-3H-benzimidazol-1-yl)propane-1-sulfonic acid

Systemtic Name: 3-(5-chloranyl-2-sulfanylidene-3H-benzimidazol-1-yl)propane-1-sulfonic acid Openeye Name: 3-(5-chloro-2-thioxo-3H-benzimidazol-1-yl)propane-1-sulfonic acid CAS Name: 3-(5-chloro-2-sulfanylidene-3H-benzimidazol-1-yl)-1-propanesulfonic acid IUPAC Name: 3-(5-chloro-2-sulfanylidene-3H-benzimidazol-1-yl)propane-1-sulfonic acid Traditional Name: 3-(5-chloro-2-thioxo-3H-benzimidazol-1-yl)propane-1-sulfonic acid Formula: C10H11ClN2O3S2 MolecularWeight: 306.78894

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1Cl)NC(=S)N2CCCS(=O)(=O)O

Isomeric SMILES

C1=CC2=C(C=C1Cl)NC(=S)N2CCCS(=O)(=O)O

InChI

InChI=1S/C10H11ClN2O3S2/c11-7-2-3-9-8(6-7)12-10(17)13(9)4-1-5-18(14,15)16/h2-3,6H,1,4-5H2,(H,12,17)(H,14,15,16)