N-[2-[4-(3-methylphenyl)piperazin-1-yl]ethyl]-4-(trifluoromethylsulfanyl)benzamide

Systemtic Name: N-[2-[4-(3-methylphenyl)piperazin-1-yl]ethyl]-4-(trifluoromethylsulfanyl)benzamide Openeye Name: N-[2-[4-(m-tolyl)piperazin-1-yl]ethyl]-4-(trifluoromethylsulfanyl)benzamide CAS Name: N-[2-[4-(3-methylphenyl)-1-piperazinyl]ethyl]-4-(trifluoromethylthio)benzamide IUPAC Name: N-[2-[4-(3-methylphenyl)piperazin-1-yl]ethyl]-4-(trifluoromethylsulfanyl)benzamide Traditional Name: N-[2-[4-(m-tolyl)piperazino]ethyl]-4-(trifluoromethylthio)benzamide Formula: C21H24F3N3OS MolecularWeight: 423.49497

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2CCN(CC2)CCNC(=O)C3=CC=C(C=C3)SC(F)(F)F

Isomeric SMILES

CC1=CC(=CC=C1)N2CCN(CC2)CCNC(=O)C3=CC=C(C=C3)SC(F)(F)F

InChI

InChI=1S/C21H24F3N3OS/c1-16-3-2-4-18(15-16)27-13-11-26(12-14-27)10-9-25-20(28)17-5-7-19(8-6-17)29-21(22,23)24/h2-8,15H,9-14H2,1H3,(H,25,28)