(2-morpholin-4-yl-2-oxidanylidene-ethyl) (1S,2S)-2-(1,3-benzothiazol-2-yl)cyclohexane-1-carboxylate

Systemtic Name: (2-morpholin-4-yl-2-oxidanylidene-ethyl) (1S,2S)-2-(1,3-benzothiazol-2-yl)cyclohexane-1-carboxylate Openeye Name: (2-morpholino-2-oxo-ethyl) (1S,2S)-2-(1,3-benzothiazol-2-yl)cyclohexanecarboxylate CAS Name: (1S,2S)-2-(1,3-benzothiazol-2-yl)-1-cyclohexanecarboxylic acid [2-(4-morpholinyl)-2-oxoethyl] ester IUPAC Name: (2-morpholin-4-yl-2-oxoethyl) (1S,2S)-2-(1,3-benzothiazol-2-yl)cyclohexane-1-carboxylate Traditional Name: (1S,2S)-2-(1,3-benzothiazol-2-yl)cyclohexanecarboxylic acid (2-keto-2-morpholino-ethyl) ester Formula: C20H24N2O4S MolecularWeight: 388.48056

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C(C1)C2=NC3=CC=CC=C3S2)C(=O)OCC(=O)N4CCOCC4

Isomeric SMILES

C1CC[C@@H]([C@H](C1)C2=NC3=CC=CC=C3S2)C(=O)OCC(=O)N4CCOCC4

InChI

InChI=1S/C20H24N2O4S/c23-18(22-9-11-25-12-10-22)13-26-20(24)15-6-2-1-5-14(15)19-21-16-7-3-4-8-17(16)27-19/h3-4,7-8,14-15H,1-2,5-6,9-13H2/t14-,15-/m0/s1