2-[6-[4-(2-fluorophenyl)piperazin-1-yl]pyrimidin-4-yl]sulfanyl-N-(oxolan-2-ylmethyl)ethanamide

Systemtic Name: 2-[6-[4-(2-fluorophenyl)piperazin-1-yl]pyrimidin-4-yl]sulfanyl-N-(oxolan-2-ylmethyl)ethanamide Openeye Name: 2-[6-[4-(2-fluorophenyl)piperazin-1-yl]pyrimidin-4-yl]sulfanyl-N-(tetrahydrofuran-2-ylmethyl)acetamide CAS Name: 2-[[6-[4-(2-fluorophenyl)-1-piperazinyl]-4-pyrimidinyl]thio]-N-(2-oxolanylmethyl)acetamide IUPAC Name: 2-[6-[4-(2-fluorophenyl)piperazin-1-yl]pyrimidin-4-yl]sulfanyl-N-(oxolan-2-ylmethyl)acetamide Traditional Name: 2-[[6-[4-(2-fluorophenyl)piperazino]pyrimidin-4-yl]thio]-N-(tetrahydrofurfuryl)acetamide Formula: C21H26FN5O2S MolecularWeight: 431.526843

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CNC(=O)CSC2=NC=NC(=C2)N3CCN(CC3)C4=CC=CC=C4F

Isomeric SMILES

C1CC(OC1)CNC(=O)CSC2=NC=NC(=C2)N3CCN(CC3)C4=CC=CC=C4F

InChI

InChI=1S/C21H26FN5O2S/c22-17-5-1-2-6-18(17)26-7-9-27(10-8-26)19-12-21(25-15-24-19)30-14-20(28)23-13-16-4-3-11-29-16/h1-2,5-6,12,15-16H,3-4,7-11,13-14H2,(H,23,28)