3-fluoranyl-N-[2-[1-(thian-4-yl)piperidin-4-yl]pyrazol-3-yl]benzamide

Systemtic Name: 3-fluoranyl-N-[2-[1-(thian-4-yl)piperidin-4-yl]pyrazol-3-yl]benzamide Openeye Name: 3-fluoro-N-[2-(1-tetrahydrothiopyran-4-yl-4-piperidyl)pyrazol-3-yl]benzamide CAS Name: 3-fluoro-N-[2-[1-(4-thianyl)-4-piperidinyl]-3-pyrazolyl]benzamide IUPAC Name: 3-fluoro-N-[2-[1-(thian-4-yl)piperidin-4-yl]pyrazol-3-yl]benzamide Traditional Name: 3-fluoro-N-[2-(1-tetrahydrothiopyran-4-yl-4-piperidyl)pyrazol-3-yl]benzamide Formula: C20H25FN4OS MolecularWeight: 388.502103

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1N2C(=CC=N2)NC(=O)C3=CC(=CC=C3)F)C4CCSCC4

Isomeric SMILES

C1CN(CCC1N2C(=CC=N2)NC(=O)C3=CC(=CC=C3)F)C4CCSCC4

InChI

InChI=1S/C20H25FN4OS/c21-16-3-1-2-15(14-16)20(26)23-19-4-9-22-25(19)18-5-10-24(11-6-18)17-7-12-27-13-8-17/h1-4,9,14,17-18H,5-8,10-13H2,(H,23,26)