[(3R)-3-(1,3-benzothiazol-2-yl)piperidin-1-yl]-(3-phenyl-1H-pyrazol-5-yl)methanone

Systemtic Name: [(3R)-3-(1,3-benzothiazol-2-yl)piperidin-1-yl]-(3-phenyl-1H-pyrazol-5-yl)methanone Openeye Name: [(3R)-3-(1,3-benzothiazol-2-yl)-1-piperidyl]-(3-phenyl-1H-pyrazol-5-yl)methanone CAS Name: [(3R)-3-(1,3-benzothiazol-2-yl)-1-piperidinyl]-(3-phenyl-1H-pyrazol-5-yl)methanone IUPAC Name: [(3R)-3-(1,3-benzothiazol-2-yl)piperidin-1-yl]-(3-phenyl-1H-pyrazol-5-yl)methanone Traditional Name: [(3R)-3-(1,3-benzothiazol-2-yl)piperidino]-(3-phenyl-1H-pyrazol-5-yl)methanone Formula: C22H20N4OS MolecularWeight: 388.4854

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)C2=CC(=NN2)C3=CC=CC=C3)C4=NC5=CC=CC=C5S4

Isomeric SMILES

C1C[C@H](CN(C1)C(=O)C2=CC(=NN2)C3=CC=CC=C3)C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C22H20N4OS/c27-22(19-13-18(24-25-19)15-7-2-1-3-8-15)26-12-6-9-16(14-26)21-23-17-10-4-5-11-20(17)28-21/h1-5,7-8,10-11,13,16H,6,9,12,14H2,(H,24,25)/t16-/m1/s1