[(3R)-3-(1,3-benzothiazol-2-yl)piperidin-1-yl]-(1-phenylpyrazol-4-yl)methanone

Systemtic Name: [(3R)-3-(1,3-benzothiazol-2-yl)piperidin-1-yl]-(1-phenylpyrazol-4-yl)methanone Openeye Name: [(3R)-3-(1,3-benzothiazol-2-yl)-1-piperidyl]-(1-phenylpyrazol-4-yl)methanone CAS Name: [(3R)-3-(1,3-benzothiazol-2-yl)-1-piperidinyl]-(1-phenyl-4-pyrazolyl)methanone IUPAC Name: [(3R)-3-(1,3-benzothiazol-2-yl)piperidin-1-yl]-(1-phenylpyrazol-4-yl)methanone Traditional Name: [(3R)-3-(1,3-benzothiazol-2-yl)piperidino]-(1-phenylpyrazol-4-yl)methanone Formula: C22H20N4OS MolecularWeight: 388.4854

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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