tert-butyl 4-(1H-imidazol-5-ylmethylamino)-2-(1,3-thiazolidin-3-ylcarbonyl)pyrrolidine-1-carboxylate

Systemtic Name: tert-butyl 4-(1H-imidazol-5-ylmethylamino)-2-(1,3-thiazolidin-3-ylcarbonyl)pyrrolidine-1-carboxylate Openeye Name: tert-butyl 4-(1H-imidazol-5-ylmethylamino)-2-(thiazolidine-3-carbonyl)pyrrolidine-1-carboxylate CAS Name: 4-(1H-imidazol-5-ylmethylamino)-2-[oxo(3-thiazolidinyl)methyl]-1-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(1H-imidazol-5-ylmethylamino)-2-(1,3-thiazolidine-3-carbonyl)pyrrolidine-1-carboxylate Traditional Name: 4-(1H-imidazol-5-ylmethylamino)-2-(thiazolidine-3-carbonyl)pyrrolidine-1-carboxylic acid tert-butyl ester Formula: C17H27N5O3S MolecularWeight: 381.49298

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CC(CC1C(=O)N2CCSC2)NCC3=CN=CN3

Isomeric SMILES

CC(C)(C)OC(=O)N1CC(CC1C(=O)N2CCSC2)NCC3=CN=CN3

InChI

InChI=1S/C17H27N5O3S/c1-17(2,3)25-16(24)22-9-12(19-8-13-7-18-10-20-13)6-14(22)15(23)21-4-5-26-11-21/h7,10,12,14,19H,4-6,8-9,11H2,1-3H3,(H,18,20)