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

Systemtic Name: 1-[[(3R)-3-(1,3-benzothiazol-2-yl)piperidin-1-yl]methyl]cinnolin-4-one Openeye Name: 1-[[(3R)-3-(1,3-benzothiazol-2-yl)-1-piperidyl]methyl]cinnolin-4-one CAS Name: 1-[[(3R)-3-(1,3-benzothiazol-2-yl)-1-piperidinyl]methyl]-4-cinnolinone IUPAC Name: 1-[[(3R)-3-(1,3-benzothiazol-2-yl)piperidin-1-yl]methyl]cinnolin-4-one Traditional Name: 1-[[(3R)-3-(1,3-benzothiazol-2-yl)piperidino]methyl]cinnolin-4-one Formula: C21H20N4OS MolecularWeight: 376.4747

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)CN2C3=CC=CC=C3C(=O)C=N2)C4=NC5=CC=CC=C5S4

Isomeric SMILES

C1C[C@H](CN(C1)CN2C3=CC=CC=C3C(=O)C=N2)C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C21H20N4OS/c26-19-12-22-25(18-9-3-1-7-16(18)19)14-24-11-5-6-15(13-24)21-23-17-8-2-4-10-20(17)27-21/h1-4,7-10,12,15H,5-6,11,13-14H2/t15-/m1/s1