N-(4-fluoranyl-1,3-benzothiazol-2-yl)-1-(phenylsulfonyl)-N-(2-pyrazol-1-ylethyl)piperidine-3-carboxamide

Systemtic Name: N-(4-fluoranyl-1,3-benzothiazol-2-yl)-1-(phenylsulfonyl)-N-(2-pyrazol-1-ylethyl)piperidine-3-carboxamide Openeye Name: 1-(benzenesulfonyl)-N-(4-fluoro-1,3-benzothiazol-2-yl)-N-(2-pyrazol-1-ylethyl)piperidine-3-carboxamide CAS Name: 1-(benzenesulfonyl)-N-(4-fluoro-1,3-benzothiazol-2-yl)-N-[2-(1-pyrazolyl)ethyl]-3-piperidinecarboxamide IUPAC Name: 1-(benzenesulfonyl)-N-(4-fluoro-1,3-benzothiazol-2-yl)-N-(2-pyrazol-1-ylethyl)piperidine-3-carboxamide Traditional Name: 1-besyl-N-(4-fluoro-1,3-benzothiazol-2-yl)-N-(2-pyrazol-1-ylethyl)nipecotamide Formula: C24H24FN5O3S2 MolecularWeight: 513.607463

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)S(=O)(=O)C2=CC=CC=C2)C(=O)N(CCN3C=CC=N3)C4=NC5=C(C=CC=C5S4)F

Isomeric SMILES

C1CC(CN(C1)S(=O)(=O)C2=CC=CC=C2)C(=O)N(CCN3C=CC=N3)C4=NC5=C(C=CC=C5S4)F

InChI

InChI=1S/C24H24FN5O3S2/c25-20-10-4-11-21-22(20)27-24(34-21)30(16-15-28-13-6-12-26-28)23(31)18-7-5-14-29(17-18)35(32,33)19-8-2-1-3-9-19/h1-4,6,8-13,18H,5,7,14-17H2