4-(2-methylsulfanylphenyl)-N-[2,3,4-tris(fluoranyl)phenyl]piperazine-1-carboxamide

Systemtic Name: 4-(2-methylsulfanylphenyl)-N-[2,3,4-tris(fluoranyl)phenyl]piperazine-1-carboxamide Openeye Name: 4-(2-methylsulfanylphenyl)-N-(2,3,4-trifluorophenyl)piperazine-1-carboxamide CAS Name: 4-[2-(methylthio)phenyl]-N-(2,3,4-trifluorophenyl)-1-piperazinecarboxamide IUPAC Name: 4-(2-methylsulfanylphenyl)-N-(2,3,4-trifluorophenyl)piperazine-1-carboxamide Traditional Name: 4-[2-(methylthio)phenyl]-N-(2,3,4-trifluorophenyl)piperazine-1-carboxamide Formula: C18H18F3N3OS MolecularWeight: 381.41523

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC=C1N2CCN(CC2)C(=O)NC3=C(C(=C(C=C3)F)F)F

Isomeric SMILES

CSC1=CC=CC=C1N2CCN(CC2)C(=O)NC3=C(C(=C(C=C3)F)F)F

InChI

InChI=1S/C18H18F3N3OS/c1-26-15-5-3-2-4-14(15)23-8-10-24(11-9-23)18(25)22-13-7-6-12(19)16(20)17(13)21/h2-7H,8-11H2,1H3,(H,22,25)