4-[[4-chloranyl-6-[4-(2-fluorophenyl)piperazin-1-yl]pyrimidin-2-yl]sulfanylmethyl]-N-(2-morpholin-4-ylethyl)benzamide

Systemtic Name: 4-[[4-chloranyl-6-[4-(2-fluorophenyl)piperazin-1-yl]pyrimidin-2-yl]sulfanylmethyl]-N-(2-morpholin-4-ylethyl)benzamide Openeye Name: 4-[[4-chloro-6-[4-(2-fluorophenyl)piperazin-1-yl]pyrimidin-2-yl]sulfanylmethyl]-N-(2-morpholinoethyl)benzamide CAS Name: 4-[[[4-chloro-6-[4-(2-fluorophenyl)-1-piperazinyl]-2-pyrimidinyl]thio]methyl]-N-[2-(4-morpholinyl)ethyl]benzamide IUPAC Name: 4-[[4-chloro-6-[4-(2-fluorophenyl)piperazin-1-yl]pyrimidin-2-yl]sulfanylmethyl]-N-(2-morpholin-4-ylethyl)benzamide Traditional Name: 4-[[[4-chloro-6-[4-(2-fluorophenyl)piperazino]pyrimidin-2-yl]thio]methyl]-N-(2-morpholinoethyl)benzamide Formula: C28H32ClFN6O2S MolecularWeight: 571.109083

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2F)C3=CC(=NC(=N3)SCC4=CC=C(C=C4)C(=O)NCCN5CCOCC5)Cl

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2F)C3=CC(=NC(=N3)SCC4=CC=C(C=C4)C(=O)NCCN5CCOCC5)Cl

InChI

InChI=1S/C28H32ClFN6O2S/c29-25-19-26(36-13-11-35(12-14-36)24-4-2-1-3-23(24)30)33-28(32-25)39-20-21-5-7-22(8-6-21)27(37)31-9-10-34-15-17-38-18-16-34/h1-8,19H,9-18,20H2,(H,31,37)