2-[(2-fluorophenyl)methylsulfanyl]-N-[4-(4-methylpiperazin-1-yl)phenyl]benzamide

Systemtic Name: 2-[(2-fluorophenyl)methylsulfanyl]-N-[4-(4-methylpiperazin-1-yl)phenyl]benzamide Openeye Name: 2-[(2-fluorophenyl)methylsulfanyl]-N-[4-(4-methylpiperazin-1-yl)phenyl]benzamide CAS Name: 2-[(2-fluorophenyl)methylthio]-N-[4-(4-methyl-1-piperazinyl)phenyl]benzamide IUPAC Name: 2-[(2-fluorophenyl)methylsulfanyl]-N-[4-(4-methylpiperazin-1-yl)phenyl]benzamide Traditional Name: 2-[(2-fluorobenzyl)thio]-N-[4-(4-methylpiperazino)phenyl]benzamide Formula: C25H26FN3OS MolecularWeight: 435.556843

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=CC=C(C=C2)NC(=O)C3=CC=CC=C3SCC4=CC=CC=C4F

Isomeric SMILES

CN1CCN(CC1)C2=CC=C(C=C2)NC(=O)C3=CC=CC=C3SCC4=CC=CC=C4F

InChI

InChI=1S/C25H26FN3OS/c1-28-14-16-29(17-15-28)21-12-10-20(11-13-21)27-25(30)22-7-3-5-9-24(22)31-18-19-6-2-4-8-23(19)26/h2-13H,14-18H2,1H3,(H,27,30)