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

Systemtic Name: N-cyclohexyl-2-[6-[4-(4-fluorophenyl)piperazin-1-yl]pyrimidin-4-yl]sulfanyl-ethanamide Openeye Name: N-cyclohexyl-2-[6-[4-(4-fluorophenyl)piperazin-1-yl]pyrimidin-4-yl]sulfanyl-acetamide CAS Name: N-cyclohexyl-2-[[6-[4-(4-fluorophenyl)-1-piperazinyl]-4-pyrimidinyl]thio]acetamide IUPAC Name: N-cyclohexyl-2-[6-[4-(4-fluorophenyl)piperazin-1-yl]pyrimidin-4-yl]sulfanylacetamide Traditional Name: N-cyclohexyl-2-[[6-[4-(4-fluorophenyl)piperazino]pyrimidin-4-yl]thio]acetamide Formula: C22H28FN5OS MolecularWeight: 429.554023

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)CSC2=NC=NC(=C2)N3CCN(CC3)C4=CC=C(C=C4)F

Isomeric SMILES

C1CCC(CC1)NC(=O)CSC2=NC=NC(=C2)N3CCN(CC3)C4=CC=C(C=C4)F

InChI

InChI=1S/C22H28FN5OS/c23-17-6-8-19(9-7-17)27-10-12-28(13-11-27)20-14-22(25-16-24-20)30-15-21(29)26-18-4-2-1-3-5-18/h6-9,14,16,18H,1-5,10-13,15H2,(H,26,29)