1,3-benzothiazol-2-ylmethyl 2-[[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]carbonylamino]ethanoate

Systemtic Name: 1,3-benzothiazol-2-ylmethyl 2-[[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]carbonylamino]ethanoate Openeye Name: 1,3-benzothiazol-2-ylmethyl 2-[[4-(2-oxopyrrolidin-1-yl)benzoyl]amino]acetate CAS Name: 2-[[oxo-[4-(2-oxo-1-pyrrolidinyl)phenyl]methyl]amino]acetic acid 1,3-benzothiazol-2-ylmethyl ester IUPAC Name: 1,3-benzothiazol-2-ylmethyl 2-[[4-(2-oxopyrrolidin-1-yl)benzoyl]amino]acetate Traditional Name: 2-[[4-(2-ketopyrrolidino)benzoyl]amino]acetic acid 1,3-benzothiazol-2-ylmethyl ester Formula: C21H19N3O4S MolecularWeight: 409.45826

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1)C2=CC=C(C=C2)C(=O)NCC(=O)OCC3=NC4=CC=CC=C4S3

Isomeric SMILES

C1CC(=O)N(C1)C2=CC=C(C=C2)C(=O)NCC(=O)OCC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C21H19N3O4S/c25-19-6-3-11-24(19)15-9-7-14(8-10-15)21(27)22-12-20(26)28-13-18-23-16-4-1-2-5-17(16)29-18/h1-2,4-5,7-10H,3,6,11-13H2,(H,22,27)