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

Systemtic Name: 3-[4-[[(4-carbamothioylphenyl)carbamoylamino]methyl]phenyl]-2-oxidanylidene-1,3-oxazolidine-5-carboxylic acid Openeye Name: 3-[4-[[(4-carbamothioylphenyl)carbamoylamino]methyl]phenyl]-2-oxo-oxazolidine-5-carboxylic acid CAS Name: 3-[4-[[[(4-carbamothioylanilino)-oxomethyl]amino]methyl]phenyl]-2-oxo-5-oxazolidinecarboxylic acid IUPAC Name: 3-[4-[[(4-carbamothioylphenyl)carbamoylamino]methyl]phenyl]-2-oxo-1,3-oxazolidine-5-carboxylic acid Traditional Name: 2-keto-3-[4-[[(4-thiocarbamoylphenyl)carbamoylamino]methyl]phenyl]oxazolidine-5-carboxylic acid Formula: C19H18N4O5S MolecularWeight: 414.43502

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(OC(=O)N1C2=CC=C(C=C2)CNC(=O)NC3=CC=C(C=C3)C(=S)N)C(=O)O

Isomeric SMILES

C1C(OC(=O)N1C2=CC=C(C=C2)CNC(=O)NC3=CC=C(C=C3)C(=S)N)C(=O)O

InChI

InChI=1S/C19H18N4O5S/c20-16(29)12-3-5-13(6-4-12)22-18(26)21-9-11-1-7-14(8-2-11)23-10-15(17(24)25)28-19(23)27/h1-8,15H,9-10H2,(H2,20,29)(H,24,25)(H2,21,22,26)