3-[[3-carboxy-5-(methylsulfonylamino)phenyl]amino]-3-oxidanylidene-2-pyrrolidin-3-yl-propanethioate

Systemtic Name: 3-[[3-carboxy-5-(methylsulfonylamino)phenyl]amino]-3-oxidanylidene-2-pyrrolidin-3-yl-propanethioate Openeye Name: 3-[3-carboxy-5-(methanesulfonamido)anilino]-3-oxo-2-pyrrolidin-3-yl-propanethioate CAS Name: 3-[3-carboxy-5-(methanesulfonamido)anilino]-3-oxo-2-(3-pyrrolidinyl)propanethioate IUPAC Name: 3-[3-carboxy-5-(methanesulfonamido)anilino]-3-oxo-2-pyrrolidin-3-ylpropanethioate Traditional Name: 3-[3-carboxy-5-(methanesulfonamido)anilino]-3-keto-2-pyrrolidin-3-yl-thiopropionate Formula: C15H18N3O6S2- MolecularWeight: 400.44992

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NC1=CC(=CC(=C1)NC(=O)C(C2CCNC2)C(=S)[O-])C(=O)O

Isomeric SMILES

CS(=O)(=O)NC1=CC(=CC(=C1)NC(=O)C(C2CCNC2)C(=S)[O-])C(=O)O

InChI

InChI=1S/C15H19N3O6S2/c1-26(23,24)18-11-5-9(14(20)21)4-10(6-11)17-13(19)12(15(22)25)8-2-3-16-7-8/h4-6,8,12,16,18H,2-3,7H2,1H3,(H,17,19)(H,20,21)(H,22,25)/p-1