(4-nitrophenyl)methyl 2-imidazo[5,1-b][1,3]thiazol-7-ylcarbonyl-4-methylsulfonyloxy-pyrrolidine-1-carboxylate

Systemtic Name: (4-nitrophenyl)methyl 2-imidazo[5,1-b][1,3]thiazol-7-ylcarbonyl-4-methylsulfonyloxy-pyrrolidine-1-carboxylate Openeye Name: (4-nitrophenyl)methyl 2-(imidazo[5,1-b]thiazole-7-carbonyl)-4-methylsulfonyloxy-pyrrolidine-1-carboxylate CAS Name: 2-[7-imidazo[5,1-b]thiazolyl(oxo)methyl]-4-methylsulfonyloxy-1-pyrrolidinecarboxylic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl 2-(imidazo[5,1-b][1,3]thiazole-7-carbonyl)-4-methylsulfonyloxypyrrolidine-1-carboxylate Traditional Name: 2-(imidazo[5,1-b]thiazole-7-carbonyl)-4-methylsulfonyloxy-pyrrolidine-1-carboxylic acid (4-nitrobenzyl) ester Formula: C19H18N4O8S2 MolecularWeight: 494.49822

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)OC1CC(N(C1)C(=O)OCC2=CC=C(C=C2)[N+](=O)[O-])C(=O)C3=C4N(C=CS4)C=N3

Isomeric SMILES

CS(=O)(=O)OC1CC(N(C1)C(=O)OCC2=CC=C(C=C2)[N+](=O)[O-])C(=O)C3=C4N(C=CS4)C=N3

InChI

InChI=1S/C19H18N4O8S2/c1-33(28,29)31-14-8-15(17(24)16-18-21(11-20-16)6-7-32-18)22(9-14)19(25)30-10-12-2-4-13(5-3-12)23(26)27/h2-7,11,14-15H,8-10H2,1H3