2-(1,3-benzothiazol-2-ylmethoxy)-1-[(3S)-3-(1,3-benzothiazol-2-yl)piperidin-1-yl]ethanone

Systemtic Name: 2-(1,3-benzothiazol-2-ylmethoxy)-1-[(3S)-3-(1,3-benzothiazol-2-yl)piperidin-1-yl]ethanone Openeye Name: 2-(1,3-benzothiazol-2-ylmethoxy)-1-[(3S)-3-(1,3-benzothiazol-2-yl)-1-piperidyl]ethanone CAS Name: 2-(1,3-benzothiazol-2-ylmethoxy)-1-[(3S)-3-(1,3-benzothiazol-2-yl)-1-piperidinyl]ethanone IUPAC Name: 2-(1,3-benzothiazol-2-ylmethoxy)-1-[(3S)-3-(1,3-benzothiazol-2-yl)piperidin-1-yl]ethanone Traditional Name: 2-(1,3-benzothiazol-2-ylmethoxy)-1-[(3S)-3-(1,3-benzothiazol-2-yl)piperidino]ethanone Formula: C22H21N3O2S2 MolecularWeight: 423.55104

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)COCC2=NC3=CC=CC=C3S2)C4=NC5=CC=CC=C5S4

Isomeric SMILES

C1C[C@@H](CN(C1)C(=O)COCC2=NC3=CC=CC=C3S2)C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C22H21N3O2S2/c26-21(14-27-13-20-23-16-7-1-3-9-18(16)28-20)25-11-5-6-15(12-25)22-24-17-8-2-4-10-19(17)29-22/h1-4,7-10,15H,5-6,11-14H2/t15-/m0/s1