1-[2-[(2R)-2-(1,3-benzothiazol-2-yl)piperidin-1-yl]-2-oxidanylidene-ethyl]cinnolin-4-one

Systemtic Name: 1-[2-[(2R)-2-(1,3-benzothiazol-2-yl)piperidin-1-yl]-2-oxidanylidene-ethyl]cinnolin-4-one Openeye Name: 1-[2-[(2R)-2-(1,3-benzothiazol-2-yl)-1-piperidyl]-2-oxo-ethyl]cinnolin-4-one CAS Name: 1-[2-[(2R)-2-(1,3-benzothiazol-2-yl)-1-piperidinyl]-2-oxoethyl]-4-cinnolinone IUPAC Name: 1-[2-[(2R)-2-(1,3-benzothiazol-2-yl)piperidin-1-yl]-2-oxoethyl]cinnolin-4-one Traditional Name: 1-[2-[(2R)-2-(1,3-benzothiazol-2-yl)piperidino]-2-keto-ethyl]cinnolin-4-one Formula: C22H20N4O2S MolecularWeight: 404.4848

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)C2=NC3=CC=CC=C3S2)C(=O)CN4C5=CC=CC=C5C(=O)C=N4

Isomeric SMILES

C1CCN([C@H](C1)C2=NC3=CC=CC=C3S2)C(=O)CN4C5=CC=CC=C5C(=O)C=N4

InChI

InChI=1S/C22H20N4O2S/c27-19-13-23-26(17-9-3-1-7-15(17)19)14-21(28)25-12-6-5-10-18(25)22-24-16-8-2-4-11-20(16)29-22/h1-4,7-9,11,13,18H,5-6,10,12,14H2/t18-/m1/s1