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

Systemtic Name: 2-[6-[4-(4-fluorophenyl)piperazin-1-yl]pyrimidin-4-yl]sulfanyl-N-(phenylmethyl)ethanamide Openeye Name: N-benzyl-2-[6-[4-(4-fluorophenyl)piperazin-1-yl]pyrimidin-4-yl]sulfanyl-acetamide CAS Name: 2-[[6-[4-(4-fluorophenyl)-1-piperazinyl]-4-pyrimidinyl]thio]-N-(phenylmethyl)acetamide IUPAC Name: N-benzyl-2-[6-[4-(4-fluorophenyl)piperazin-1-yl]pyrimidin-4-yl]sulfanylacetamide Traditional Name: N-benzyl-2-[[6-[4-(4-fluorophenyl)piperazino]pyrimidin-4-yl]thio]acetamide Formula: C23H24FN5OS MolecularWeight: 437.532963

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)F)C3=CC(=NC=N3)SCC(=O)NCC4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)F)C3=CC(=NC=N3)SCC(=O)NCC4=CC=CC=C4

InChI

InChI=1S/C23H24FN5OS/c24-19-6-8-20(9-7-19)28-10-12-29(13-11-28)21-14-23(27-17-26-21)31-16-22(30)25-15-18-4-2-1-3-5-18/h1-9,14,17H,10-13,15-16H2,(H,25,30)