[2,6-di(propan-2-yl)phenyl] 4-oxidanylidene-4-(2-thiomorpholin-4-ylethylamino)butanoate

Systemtic Name: [2,6-di(propan-2-yl)phenyl] 4-oxidanylidene-4-(2-thiomorpholin-4-ylethylamino)butanoate Openeye Name: (2,6-diisopropylphenyl) 4-oxo-4-(2-thiomorpholinoethylamino)butanoate CAS Name: 4-oxo-4-(2-thiomorpholin-4-ylethylamino)butanoic acid [2,6-di(propan-2-yl)phenyl] ester IUPAC Name: [2,6-di(propan-2-yl)phenyl] 4-oxo-4-(2-thiomorpholin-4-ylethylamino)butanoate Traditional Name: 4-keto-4-(2-thiomorpholinoethylamino)butyric acid (2,6-diisopropylphenyl) ester Formula: C22H34N2O3S MolecularWeight: 406.58196

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C(=CC=C1)C(C)C)OC(=O)CCC(=O)NCCN2CCSCC2

Isomeric SMILES

CC(C)C1=C(C(=CC=C1)C(C)C)OC(=O)CCC(=O)NCCN2CCSCC2

InChI

InChI=1S/C22H34N2O3S/c1-16(2)18-6-5-7-19(17(3)4)22(18)27-21(26)9-8-20(25)23-10-11-24-12-14-28-15-13-24/h5-7,16-17H,8-15H2,1-4H3,(H,23,25)