3-[4-[[(4-carbamothioylphenyl)carbonylamino]methyl]phenyl]-2-oxidanylidene-1,3-oxazolidine-5-carboxylic acid

Systemtic Name: 3-[4-[[(4-carbamothioylphenyl)carbonylamino]methyl]phenyl]-2-oxidanylidene-1,3-oxazolidine-5-carboxylic acid Openeye Name: 3-[4-[[(4-carbamothioylbenzoyl)amino]methyl]phenyl]-2-oxo-oxazolidine-5-carboxylic acid CAS Name: 3-[4-[[[(4-carbamothioylphenyl)-oxomethyl]amino]methyl]phenyl]-2-oxo-5-oxazolidinecarboxylic acid IUPAC Name: 3-[4-[[(4-carbamothioylbenzoyl)amino]methyl]phenyl]-2-oxo-1,3-oxazolidine-5-carboxylic acid Traditional Name: 2-keto-3-[4-[[(4-thiocarbamoylbenzoyl)amino]methyl]phenyl]oxazolidine-5-carboxylic acid Formula: C19H17N3O5S MolecularWeight: 399.42038

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC(=O)N1C2=CC=C(C=C2)CNC(=O)C3=CC=C(C=C3)C(=S)N)C(=O)O

Isomeric SMILES

C1C(OC(=O)N1C2=CC=C(C=C2)CNC(=O)C3=CC=C(C=C3)C(=S)N)C(=O)O

InChI

InChI=1S/C19H17N3O5S/c20-16(28)12-3-5-13(6-4-12)17(23)21-9-11-1-7-14(8-2-11)22-10-15(18(24)25)27-19(22)26/h1-8,15H,9-10H2,(H2,20,28)(H,21,23)(H,24,25)