1-[3-(1,3-benzothiazol-2-yl)piperidin-1-yl]-2-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)ethanone

Systemtic Name: 1-[3-(1,3-benzothiazol-2-yl)piperidin-1-yl]-2-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)ethanone Openeye Name: 1-[3-(1,3-benzothiazol-2-yl)-1-piperidyl]-2-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)ethanone CAS Name: 1-[3-(1,3-benzothiazol-2-yl)-1-piperidinyl]-2-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)ethanone IUPAC Name: 1-[3-(1,3-benzothiazol-2-yl)piperidin-1-yl]-2-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)ethanone Traditional Name: 1-[3-(1,3-benzothiazol-2-yl)piperidino]-2-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)ethanone Formula: C23H25N3OS2 MolecularWeight: 423.5941

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)CN2CCCSC3=CC=CC=C32)C4=NC5=CC=CC=C5S4

Isomeric SMILES

C1CC(CN(C1)C(=O)CN2CCCSC3=CC=CC=C32)C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C23H25N3OS2/c27-22(16-25-13-6-14-28-21-11-4-2-9-19(21)25)26-12-5-7-17(15-26)23-24-18-8-1-3-10-20(18)29-23/h1-4,8-11,17H,5-7,12-16H2