N-[2-(4-dimethylaminophenyl)-2-(4-methylpiperazin-1-yl)ethyl]-2-(4-fluorophenyl)sulfanyl-ethanamide

Systemtic Name: N-[2-(4-dimethylaminophenyl)-2-(4-methylpiperazin-1-yl)ethyl]-2-(4-fluorophenyl)sulfanyl-ethanamide Openeye Name: N-[2-(4-dimethylaminophenyl)-2-(4-methylpiperazin-1-yl)ethyl]-2-(4-fluorophenyl)sulfanyl-acetamide CAS Name: N-[2-(4-dimethylaminophenyl)-2-(4-methyl-1-piperazinyl)ethyl]-2-[(4-fluorophenyl)thio]acetamide IUPAC Name: N-[2-(4-dimethylaminophenyl)-2-(4-methylpiperazin-1-yl)ethyl]-2-(4-fluorophenyl)sulfanylacetamide Traditional Name: N-[2-(4-dimethylaminophenyl)-2-(4-methylpiperazino)ethyl]-2-[(4-fluorophenyl)thio]acetamide Formula: C23H31FN4OS MolecularWeight: 430.581843

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C(CNC(=O)CSC2=CC=C(C=C2)F)C3=CC=C(C=C3)N(C)C

Isomeric SMILES

CN1CCN(CC1)C(CNC(=O)CSC2=CC=C(C=C2)F)C3=CC=C(C=C3)N(C)C

InChI

InChI=1S/C23H31FN4OS/c1-26(2)20-8-4-18(5-9-20)22(28-14-12-27(3)13-15-28)16-25-23(29)17-30-21-10-6-19(24)7-11-21/h4-11,22H,12-17H2,1-3H3,(H,25,29)