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

Systemtic Name: 1-[(2R)-2-(1,3-benzothiazol-2-yl)piperidin-1-yl]-3-(1-phenylpyrazol-4-yl)propan-1-one Openeye Name: 1-[(2R)-2-(1,3-benzothiazol-2-yl)-1-piperidyl]-3-(1-phenylpyrazol-4-yl)propan-1-one CAS Name: 1-[(2R)-2-(1,3-benzothiazol-2-yl)-1-piperidinyl]-3-(1-phenyl-4-pyrazolyl)-1-propanone IUPAC Name: 1-[(2R)-2-(1,3-benzothiazol-2-yl)piperidin-1-yl]-3-(1-phenylpyrazol-4-yl)propan-1-one Traditional Name: 1-[(2R)-2-(1,3-benzothiazol-2-yl)piperidino]-3-(1-phenylpyrazol-4-yl)propan-1-one Formula: C24H24N4OS MolecularWeight: 416.53856

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)C2=NC3=CC=CC=C3S2)C(=O)CCC4=CN(N=C4)C5=CC=CC=C5

Isomeric SMILES

C1CCN([C@H](C1)C2=NC3=CC=CC=C3S2)C(=O)CCC4=CN(N=C4)C5=CC=CC=C5

InChI

InChI=1S/C24H24N4OS/c29-23(14-13-18-16-25-28(17-18)19-8-2-1-3-9-19)27-15-7-6-11-21(27)24-26-20-10-4-5-12-22(20)30-24/h1-5,8-10,12,16-17,21H,6-7,11,13-15H2/t21-/m1/s1