tert-butyl 2,6-dimethyl-3-oxidanylidene-2-(phenylmethyl)-5-propyl-thiomorpholine-4-carboxylate

Systemtic Name: tert-butyl 2,6-dimethyl-3-oxidanylidene-2-(phenylmethyl)-5-propyl-thiomorpholine-4-carboxylate Openeye Name: tert-butyl 2-benzyl-2,6-dimethyl-3-oxo-5-propyl-thiomorpholine-4-carboxylate CAS Name: 2,6-dimethyl-3-oxo-2-(phenylmethyl)-5-propyl-4-thiomorpholinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 2-benzyl-2,6-dimethyl-3-oxo-5-propylthiomorpholine-4-carboxylate Traditional Name: 2-benzyl-3-keto-2,6-dimethyl-5-propyl-thiomorpholine-4-carboxylic acid tert-butyl ester Formula: C21H31NO3S MolecularWeight: 377.54074

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1C(SC(C(=O)N1C(=O)OC(C)(C)C)(C)CC2=CC=CC=C2)C

Isomeric SMILES

CCCC1C(SC(C(=O)N1C(=O)OC(C)(C)C)(C)CC2=CC=CC=C2)C

InChI

InChI=1S/C21H31NO3S/c1-7-11-17-15(2)26-21(6,14-16-12-9-8-10-13-16)18(23)22(17)19(24)25-20(3,4)5/h8-10,12-13,15,17H,7,11,14H2,1-6H3