2-[5-(4-fluorophenyl)-1-(furan-2-ylmethyl)imidazol-2-yl]sulfanyl-1-piperidin-1-yl-ethanone

Systemtic Name: 2-[5-(4-fluorophenyl)-1-(furan-2-ylmethyl)imidazol-2-yl]sulfanyl-1-piperidin-1-yl-ethanone Openeye Name: 2-[5-(4-fluorophenyl)-1-(2-furylmethyl)imidazol-2-yl]sulfanyl-1-(1-piperidyl)ethanone CAS Name: 2-[[5-(4-fluorophenyl)-1-(2-furanylmethyl)-2-imidazolyl]thio]-1-(1-piperidinyl)ethanone IUPAC Name: 2-[5-(4-fluorophenyl)-1-(furan-2-ylmethyl)imidazol-2-yl]sulfanyl-1-piperidin-1-ylethanone Traditional Name: 2-[[5-(4-fluorophenyl)-1-(2-furfuryl)imidazol-2-yl]thio]-1-piperidino-ethanone Formula: C21H22FN3O2S MolecularWeight: 399.481683

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)CSC2=NC=C(N2CC3=CC=CO3)C4=CC=C(C=C4)F

Isomeric SMILES

C1CCN(CC1)C(=O)CSC2=NC=C(N2CC3=CC=CO3)C4=CC=C(C=C4)F

InChI

InChI=1S/C21H22FN3O2S/c22-17-8-6-16(7-9-17)19-13-23-21(25(19)14-18-5-4-12-27-18)28-15-20(26)24-10-2-1-3-11-24/h4-9,12-13H,1-3,10-11,14-15H2