1-[3-[5-(4-fluorophenyl)-2-methyl-pyrimidin-4-yl]piperidin-1-yl]-2-thiophen-2-yl-ethanone

Systemtic Name: 1-[3-[5-(4-fluorophenyl)-2-methyl-pyrimidin-4-yl]piperidin-1-yl]-2-thiophen-2-yl-ethanone Openeye Name: 1-[3-[5-(4-fluorophenyl)-2-methyl-pyrimidin-4-yl]-1-piperidyl]-2-(2-thienyl)ethanone CAS Name: 1-[3-[5-(4-fluorophenyl)-2-methyl-4-pyrimidinyl]-1-piperidinyl]-2-thiophen-2-ylethanone IUPAC Name: 1-[3-[5-(4-fluorophenyl)-2-methylpyrimidin-4-yl]piperidin-1-yl]-2-thiophen-2-ylethanone Traditional Name: 1-[3-[5-(4-fluorophenyl)-2-methyl-pyrimidin-4-yl]piperidino]-2-(2-thienyl)ethanone Formula: C22H22FN3OS MolecularWeight: 395.492983

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(C(=N1)C2CCCN(C2)C(=O)CC3=CC=CS3)C4=CC=C(C=C4)F

Isomeric SMILES

CC1=NC=C(C(=N1)C2CCCN(C2)C(=O)CC3=CC=CS3)C4=CC=C(C=C4)F

InChI

InChI=1S/C22H22FN3OS/c1-15-24-13-20(16-6-8-18(23)9-7-16)22(25-15)17-4-2-10-26(14-17)21(27)12-19-5-3-11-28-19/h3,5-9,11,13,17H,2,4,10,12,14H2,1H3