1-[(3R)-3-(1,3-benzothiazol-2-yl)piperidin-1-yl]-2-(5-ethanoyl-2-methoxy-phenyl)ethanone

Systemtic Name: 1-[(3R)-3-(1,3-benzothiazol-2-yl)piperidin-1-yl]-2-(5-ethanoyl-2-methoxy-phenyl)ethanone Openeye Name: 2-(5-acetyl-2-methoxy-phenyl)-1-[(3R)-3-(1,3-benzothiazol-2-yl)-1-piperidyl]ethanone CAS Name: 2-(5-acetyl-2-methoxyphenyl)-1-[(3R)-3-(1,3-benzothiazol-2-yl)-1-piperidinyl]ethanone IUPAC Name: 2-(5-acetyl-2-methoxyphenyl)-1-[(3R)-3-(1,3-benzothiazol-2-yl)piperidin-1-yl]ethanone Traditional Name: 2-(5-acetyl-2-methoxy-phenyl)-1-[(3R)-3-(1,3-benzothiazol-2-yl)piperidino]ethanone Formula: C23H24N2O3S MolecularWeight: 408.51326

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C=C1)OC)CC(=O)N2CCCC(C2)C3=NC4=CC=CC=C4S3

Isomeric SMILES

CC(=O)C1=CC(=C(C=C1)OC)CC(=O)N2CCC[C@H](C2)C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C23H24N2O3S/c1-15(26)16-9-10-20(28-2)18(12-16)13-22(27)25-11-5-6-17(14-25)23-24-19-7-3-4-8-21(19)29-23/h3-4,7-10,12,17H,5-6,11,13-14H2,1-2H3/t17-/m1/s1