butyl (2S,4S)-3-(4-tert-butylphenyl)carbonyl-2-propan-2-yl-1,3-thiazolidine-4-carboxylate

Systemtic Name: butyl (2S,4S)-3-(4-tert-butylphenyl)carbonyl-2-propan-2-yl-1,3-thiazolidine-4-carboxylate Openeye Name: butyl (2S,4S)-3-(4-tert-butylbenzoyl)-2-isopropyl-thiazolidine-4-carboxylate CAS Name: (2S,4S)-3-[(4-tert-butylphenyl)-oxomethyl]-2-propan-2-yl-4-thiazolidinecarboxylic acid butyl ester IUPAC Name: butyl (2S,4S)-3-(4-tert-butylbenzoyl)-2-propan-2-yl-1,3-thiazolidine-4-carboxylate Traditional Name: (2S,4S)-3-(4-tert-butylbenzoyl)-2-isopropyl-thiazolidine-4-carboxylic acid butyl ester Formula: C22H33NO3S MolecularWeight: 391.56732

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1CSC(N1C(=O)C2=CC=C(C=C2)C(C)(C)C)C(C)C

Isomeric SMILES

CCCCOC(=O)[C@H]1CS[C@H](N1C(=O)C2=CC=C(C=C2)C(C)(C)C)C(C)C

InChI

InChI=1S/C22H33NO3S/c1-7-8-13-26-21(25)18-14-27-20(15(2)3)23(18)19(24)16-9-11-17(12-10-16)22(4,5)6/h9-12,15,18,20H,7-8,13-14H2,1-6H3/t18-,20+/m1/s1