(2-oxidanylidene-2-piperidin-1-yl-ethyl) (2S)-3-(1,3-benzothiazol-2-yl)-2-methyl-2-phenyl-propanoate

Systemtic Name: (2-oxidanylidene-2-piperidin-1-yl-ethyl) (2S)-3-(1,3-benzothiazol-2-yl)-2-methyl-2-phenyl-propanoate Openeye Name: [2-oxo-2-(1-piperidyl)ethyl] (2S)-3-(1,3-benzothiazol-2-yl)-2-methyl-2-phenyl-propanoate CAS Name: (2S)-3-(1,3-benzothiazol-2-yl)-2-methyl-2-phenylpropanoic acid [2-oxo-2-(1-piperidinyl)ethyl] ester IUPAC Name: (2-oxo-2-piperidin-1-ylethyl) (2S)-3-(1,3-benzothiazol-2-yl)-2-methyl-2-phenylpropanoate Traditional Name: (2S)-3-(1,3-benzothiazol-2-yl)-2-methyl-2-phenyl-propionic acid (2-keto-2-piperidino-ethyl) ester Formula: C24H26N2O3S MolecularWeight: 422.53984

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=NC2=CC=CC=C2S1)(C3=CC=CC=C3)C(=O)OCC(=O)N4CCCCC4

Isomeric SMILES

C[C@](CC1=NC2=CC=CC=C2S1)(C3=CC=CC=C3)C(=O)OCC(=O)N4CCCCC4

InChI

InChI=1S/C24H26N2O3S/c1-24(18-10-4-2-5-11-18,16-21-25-19-12-6-7-13-20(19)30-21)23(28)29-17-22(27)26-14-8-3-9-15-26/h2,4-7,10-13H,3,8-9,14-17H2,1H3/t24-/m0/s1