tert-butyl (2S,4S)-2-(4-chlorophenyl)-4-(2-dimethylaminoethylcarbamoyl)-1,3-thiazolidine-3-carboxylate

Systemtic Name: tert-butyl (2S,4S)-2-(4-chlorophenyl)-4-(2-dimethylaminoethylcarbamoyl)-1,3-thiazolidine-3-carboxylate Openeye Name: tert-butyl (2S,4S)-2-(4-chlorophenyl)-4-(2-dimethylaminoethylcarbamoyl)thiazolidine-3-carboxylate CAS Name: (2S,4S)-2-(4-chlorophenyl)-4-[(2-dimethylaminoethylamino)-oxomethyl]-3-thiazolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (2S,4S)-2-(4-chlorophenyl)-4-(2-dimethylaminoethylcarbamoyl)-1,3-thiazolidine-3-carboxylate Traditional Name: (2S,4S)-2-(4-chlorophenyl)-4-(2-dimethylaminoethylcarbamoyl)thiazolidine-3-carboxylic acid tert-butyl ester Formula: C19H28ClN3O3S MolecularWeight: 413.96192

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1C(CSC1C2=CC=C(C=C2)Cl)C(=O)NCCN(C)C

Isomeric SMILES

CC(C)(C)OC(=O)N1[C@H](CS[C@H]1C2=CC=C(C=C2)Cl)C(=O)NCCN(C)C

InChI

InChI=1S/C19H28ClN3O3S/c1-19(2,3)26-18(25)23-15(16(24)21-10-11-22(4)5)12-27-17(23)13-6-8-14(20)9-7-13/h6-9,15,17H,10-12H2,1-5H3,(H,21,24)/t15-,17+/m1/s1