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

Systemtic Name: butyl (2S,4S)-2-(2-chlorophenyl)-3-cyclohexylcarbonyl-1,3-thiazolidine-4-carboxylate Openeye Name: butyl (2S,4S)-2-(2-chlorophenyl)-3-(cyclohexanecarbonyl)thiazolidine-4-carboxylate CAS Name: (2S,4S)-2-(2-chlorophenyl)-3-[cyclohexyl(oxo)methyl]-4-thiazolidinecarboxylic acid butyl ester IUPAC Name: butyl (2S,4S)-2-(2-chlorophenyl)-3-(cyclohexanecarbonyl)-1,3-thiazolidine-4-carboxylate Traditional Name: (2S,4S)-2-(2-chlorophenyl)-3-(cyclohexanecarbonyl)thiazolidine-4-carboxylic acid butyl ester Formula: C21H28ClNO3S MolecularWeight: 409.96992

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1CSC(N1C(=O)C2CCCCC2)C3=CC=CC=C3Cl

Isomeric SMILES

CCCCOC(=O)[C@H]1CS[C@H](N1C(=O)C2CCCCC2)C3=CC=CC=C3Cl

InChI

InChI=1S/C21H28ClNO3S/c1-2-3-13-26-21(25)18-14-27-20(16-11-7-8-12-17(16)22)23(18)19(24)15-9-5-4-6-10-15/h7-8,11-12,15,18,20H,2-6,9-10,13-14H2,1H3/t18-,20+/m1/s1