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

Systemtic Name: 1-[(3S)-3-[5-(2-fluorophenyl)-2-pyridin-3-yl-pyrimidin-4-yl]piperidin-1-yl]-2-thiophen-2-yl-ethanone Openeye Name: 1-[(3S)-3-[5-(2-fluorophenyl)-2-(3-pyridyl)pyrimidin-4-yl]-1-piperidyl]-2-(2-thienyl)ethanone CAS Name: 1-[(3S)-3-[5-(2-fluorophenyl)-2-(3-pyridinyl)-4-pyrimidinyl]-1-piperidinyl]-2-thiophen-2-ylethanone IUPAC Name: 1-[(3S)-3-[5-(2-fluorophenyl)-2-pyridin-3-ylpyrimidin-4-yl]piperidin-1-yl]-2-thiophen-2-ylethanone Traditional Name: 1-[(3S)-3-[5-(2-fluorophenyl)-2-(3-pyridyl)pyrimidin-4-yl]piperidino]-2-(2-thienyl)ethanone Formula: C26H23FN4OS MolecularWeight: 458.550423

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)CC2=CC=CS2)C3=NC(=NC=C3C4=CC=CC=C4F)C5=CN=CC=C5

Isomeric SMILES

C1C[C@@H](CN(C1)C(=O)CC2=CC=CS2)C3=NC(=NC=C3C4=CC=CC=C4F)C5=CN=CC=C5

InChI

InChI=1S/C26H23FN4OS/c27-23-10-2-1-9-21(23)22-16-29-26(18-6-3-11-28-15-18)30-25(22)19-7-4-12-31(17-19)24(32)14-20-8-5-13-33-20/h1-3,5-6,8-11,13,15-16,19H,4,7,12,14,17H2/t19-/m0/s1