4-[2-oxidanylidene-2-(2-thiophen-2-ylethylamino)ethyl]sulfanylbenzoic acid

Systemtic Name: 4-[2-oxidanylidene-2-(2-thiophen-2-ylethylamino)ethyl]sulfanylbenzoic acid Openeye Name: 4-[2-oxo-2-[2-(2-thienyl)ethylamino]ethyl]sulfanylbenzoic acid CAS Name: 4-[[2-oxo-2-(2-thiophen-2-ylethylamino)ethyl]thio]benzoic acid IUPAC Name: 4-[2-oxo-2-(2-thiophen-2-ylethylamino)ethyl]sulfanylbenzoic acid Traditional Name: 4-[[2-keto-2-[2-(2-thienyl)ethylamino]ethyl]thio]benzoic acid Formula: C15H15NO3S2 MolecularWeight: 321.4145

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)CCNC(=O)CSC2=CC=C(C=C2)C(=O)O

Isomeric SMILES

C1=CSC(=C1)CCNC(=O)CSC2=CC=C(C=C2)C(=O)O

InChI

InChI=1S/C15H15NO3S2/c17-14(16-8-7-12-2-1-9-20-12)10-21-13-5-3-11(4-6-13)15(18)19/h1-6,9H,7-8,10H2,(H,16,17)(H,18,19)