2,4-bis(chloranyl)-6-(5-thiophen-3-ylpentanethioylamino)benzoic acid

Systemtic Name: 2,4-bis(chloranyl)-6-(5-thiophen-3-ylpentanethioylamino)benzoic acid Openeye Name: 2,4-dichloro-6-[5-(3-thienyl)pentanethioylamino]benzoic acid CAS Name: 2,4-dichloro-6-[[1-sulfanylidene-5-(3-thiophenyl)pentyl]amino]benzoic acid IUPAC Name: 2,4-dichloro-6-(5-thiophen-3-ylpentanethioylamino)benzoic acid Traditional Name: 2,4-dichloro-6-[5-(3-thienyl)pentanethioylamino]benzoic acid Formula: C16H15Cl2NO2S2 MolecularWeight: 388.3318

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC=C1CCCCC(=S)NC2=CC(=CC(=C2C(=O)O)Cl)Cl

Isomeric SMILES

C1=CSC=C1CCCCC(=S)NC2=CC(=CC(=C2C(=O)O)Cl)Cl

InChI

InChI=1S/C16H15Cl2NO2S2/c17-11-7-12(18)15(16(20)21)13(8-11)19-14(22)4-2-1-3-10-5-6-23-9-10/h5-9H,1-4H2,(H,19,22)(H,20,21)