4-[2-[(5S)-4-oxidanylidene-2-pyrrolidin-1-yl-1,3-thiazol-5-yl]ethanoylamino]benzoate

Systemtic Name: 4-[2-[(5S)-4-oxidanylidene-2-pyrrolidin-1-yl-1,3-thiazol-5-yl]ethanoylamino]benzoate Openeye Name: 4-[[2-[(5S)-4-oxo-2-pyrrolidin-1-yl-thiazol-5-yl]acetyl]amino]benzoate CAS Name: 4-[[1-oxo-2-[(5S)-4-oxo-2-(1-pyrrolidinyl)-5-thiazolyl]ethyl]amino]benzoate IUPAC Name: 4-[[2-[(5S)-4-oxo-2-pyrrolidin-1-yl-1,3-thiazol-5-yl]acetyl]amino]benzoate Traditional Name: 4-[[2-[(5S)-4-keto-2-pyrrolidino-2-thiazolin-5-yl]acetyl]amino]benzoate Formula: C16H16N3O4S- MolecularWeight: 346.38094

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=NC(=O)C(S2)CC(=O)NC3=CC=C(C=C3)C(=O)[O-]

Isomeric SMILES

C1CCN(C1)C2=NC(=O)[C@@H](S2)CC(=O)NC3=CC=C(C=C3)C(=O)[O-]

InChI

InChI=1S/C16H17N3O4S/c20-13(17-11-5-3-10(4-6-11)15(22)23)9-12-14(21)18-16(24-12)19-7-1-2-8-19/h3-6,12H,1-2,7-9H2,(H,17,20)(H,22,23)/p-1/t12-/m0/s1