(4-nitrophenyl)methyl 4-sulfanyl-2-(1,3-thiazol-4-yl)pyrrolidine-1-carboxylate

Systemtic Name: (4-nitrophenyl)methyl 4-sulfanyl-2-(1,3-thiazol-4-yl)pyrrolidine-1-carboxylate Openeye Name: (4-nitrophenyl)methyl 4-sulfanyl-2-thiazol-4-yl-pyrrolidine-1-carboxylate CAS Name: 4-mercapto-2-(4-thiazolyl)-1-pyrrolidinecarboxylic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl 4-sulfanyl-2-(1,3-thiazol-4-yl)pyrrolidine-1-carboxylate Traditional Name: 4-mercapto-2-thiazol-4-yl-pyrrolidine-1-carboxylic acid (4-nitrobenzyl) ester Formula: C15H15N3O4S2 MolecularWeight: 365.4273

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(CN(C1C2=CSC=N2)C(=O)OCC3=CC=C(C=C3)[N+](=O)[O-])S

Isomeric SMILES

C1C(CN(C1C2=CSC=N2)C(=O)OCC3=CC=C(C=C3)[N+](=O)[O-])S

InChI

InChI=1S/C15H15N3O4S2/c19-15(22-7-10-1-3-11(4-2-10)18(20)21)17-6-12(23)5-14(17)13-8-24-9-16-13/h1-4,8-9,12,14,23H,5-7H2