4-[[4-[3-(2-oxidanylidenepyrrolidin-1-yl)phenyl]-1,3-thiazol-2-yl]amino]benzoate

Systemtic Name: 4-[[4-[3-(2-oxidanylidenepyrrolidin-1-yl)phenyl]-1,3-thiazol-2-yl]amino]benzoate Openeye Name: 4-[[4-[3-(2-oxopyrrolidin-1-yl)phenyl]thiazol-2-yl]amino]benzoate CAS Name: 4-[[4-[3-(2-oxo-1-pyrrolidinyl)phenyl]-2-thiazolyl]amino]benzoate IUPAC Name: 4-[[4-[3-(2-oxopyrrolidin-1-yl)phenyl]-1,3-thiazol-2-yl]amino]benzoate Traditional Name: 4-[[4-[3-(2-ketopyrrolidino)phenyl]thiazol-2-yl]amino]benzoate Formula: C20H16N3O3S- MolecularWeight: 378.42434

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1)C2=CC=CC(=C2)C3=CSC(=N3)NC4=CC=C(C=C4)C(=O)[O-]

Isomeric SMILES

C1CC(=O)N(C1)C2=CC=CC(=C2)C3=CSC(=N3)NC4=CC=C(C=C4)C(=O)[O-]

InChI

InChI=1S/C20H17N3O3S/c24-18-5-2-10-23(18)16-4-1-3-14(11-16)17-12-27-20(22-17)21-15-8-6-13(7-9-15)19(25)26/h1,3-4,6-9,11-12H,2,5,10H2,(H,21,22)(H,25,26)/p-1