2-[2-oxidanylidene-2-(quinolin-4-ylamino)ethyl]sulfanylbenzoic acid

Systemtic Name: 2-[2-oxidanylidene-2-(quinolin-4-ylamino)ethyl]sulfanylbenzoic acid Openeye Name: 2-[2-oxo-2-(4-quinolylamino)ethyl]sulfanylbenzoic acid CAS Name: 2-[[2-oxo-2-(4-quinolinylamino)ethyl]thio]benzoic acid IUPAC Name: 2-[2-oxo-2-(quinolin-4-ylamino)ethyl]sulfanylbenzoic acid Traditional Name: 2-[[2-keto-2-(4-quinolylamino)ethyl]thio]benzoic acid Formula: C18H14N2O3S MolecularWeight: 338.38036

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CC=N2)NC(=O)CSC3=CC=CC=C3C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=CC=N2)NC(=O)CSC3=CC=CC=C3C(=O)O

InChI

InChI=1S/C18H14N2O3S/c21-17(11-24-16-8-4-2-6-13(16)18(22)23)20-15-9-10-19-14-7-3-1-5-12(14)15/h1-10H,11H2,(H,22,23)(H,19,20,21)