2-[2-[[3-(ethylcarbamoyl)phenyl]amino]-2-oxidanylidene-ethyl]sulfanylbenzoic acid

Systemtic Name: 2-[2-[[3-(ethylcarbamoyl)phenyl]amino]-2-oxidanylidene-ethyl]sulfanylbenzoic acid Openeye Name: 2-[2-[3-(ethylcarbamoyl)anilino]-2-oxo-ethyl]sulfanylbenzoic acid CAS Name: 2-[[2-[3-(ethylcarbamoyl)anilino]-2-oxoethyl]thio]benzoic acid IUPAC Name: 2-[2-[3-(ethylcarbamoyl)anilino]-2-oxoethyl]sulfanylbenzoic acid Traditional Name: 2-[[2-[3-(ethylcarbamoyl)anilino]-2-keto-ethyl]thio]benzoic acid Formula: C18H18N2O4S MolecularWeight: 358.41152

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C1=CC(=CC=C1)NC(=O)CSC2=CC=CC=C2C(=O)O

Isomeric SMILES

CCNC(=O)C1=CC(=CC=C1)NC(=O)CSC2=CC=CC=C2C(=O)O

InChI

InChI=1S/C18H18N2O4S/c1-2-19-17(22)12-6-5-7-13(10-12)20-16(21)11-25-15-9-4-3-8-14(15)18(23)24/h3-10H,2,11H2,1H3,(H,19,22)(H,20,21)(H,23,24)