2-[[3-(4-fluorophenyl)-6-phenyl-2H-1,3,5-triazin-4-yl]sulfanyl]-1-piperidin-1-yl-ethanone

Systemtic Name: 2-[[3-(4-fluorophenyl)-6-phenyl-2H-1,3,5-triazin-4-yl]sulfanyl]-1-piperidin-1-yl-ethanone Openeye Name: 2-[[3-(4-fluorophenyl)-6-phenyl-2H-1,3,5-triazin-4-yl]sulfanyl]-1-(1-piperidyl)ethanone CAS Name: 2-[[3-(4-fluorophenyl)-6-phenyl-2H-1,3,5-triazin-4-yl]thio]-1-(1-piperidinyl)ethanone IUPAC Name: 2-[[3-(4-fluorophenyl)-6-phenyl-2H-1,3,5-triazin-4-yl]sulfanyl]-1-piperidin-1-ylethanone Traditional Name: 2-[[3-(4-fluorophenyl)-6-phenyl-2H-s-triazin-4-yl]thio]-1-piperidino-ethanone Formula: C22H23FN4OS MolecularWeight: 410.507623

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)CSC2=NC(=NCN2C3=CC=C(C=C3)F)C4=CC=CC=C4

Isomeric SMILES

C1CCN(CC1)C(=O)CSC2=NC(=NCN2C3=CC=C(C=C3)F)C4=CC=CC=C4

InChI

InChI=1S/C22H23FN4OS/c23-18-9-11-19(12-10-18)27-16-24-21(17-7-3-1-4-8-17)25-22(27)29-15-20(28)26-13-5-2-6-14-26/h1,3-4,7-12H,2,5-6,13-16H2