4-[2-[(3-cyanothiophen-2-yl)amino]-2-oxidanylidene-ethyl]sulfanylbenzoic acid

Systemtic Name: 4-[2-[(3-cyanothiophen-2-yl)amino]-2-oxidanylidene-ethyl]sulfanylbenzoic acid Openeye Name: 4-[2-[(3-cyano-2-thienyl)amino]-2-oxo-ethyl]sulfanylbenzoic acid CAS Name: 4-[[2-[(3-cyano-2-thiophenyl)amino]-2-oxoethyl]thio]benzoic acid IUPAC Name: 4-[2-[(3-cyanothiophen-2-yl)amino]-2-oxoethyl]sulfanylbenzoic acid Traditional Name: 4-[[2-[(3-cyano-2-thienyl)amino]-2-keto-ethyl]thio]benzoic acid Formula: C14H10N2O3S2 MolecularWeight: 318.3708

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)O)SCC(=O)NC2=C(C=CS2)C#N

Isomeric SMILES

C1=CC(=CC=C1C(=O)O)SCC(=O)NC2=C(C=CS2)C#N

InChI

InChI=1S/C14H10N2O3S2/c15-7-10-5-6-20-13(10)16-12(17)8-21-11-3-1-9(2-4-11)14(18)19/h1-6H,8H2,(H,16,17)(H,18,19)