N-[3-fluoranyl-4-(4-phenylpiperazin-1-yl)phenyl]-2-(4-methoxyphenyl)sulfanyl-ethanamide

Systemtic Name: N-[3-fluoranyl-4-(4-phenylpiperazin-1-yl)phenyl]-2-(4-methoxyphenyl)sulfanyl-ethanamide Openeye Name: N-[3-fluoro-4-(4-phenylpiperazin-1-yl)phenyl]-2-(4-methoxyphenyl)sulfanyl-acetamide CAS Name: N-[3-fluoro-4-(4-phenyl-1-piperazinyl)phenyl]-2-[(4-methoxyphenyl)thio]acetamide IUPAC Name: N-[3-fluoro-4-(4-phenylpiperazin-1-yl)phenyl]-2-(4-methoxyphenyl)sulfanylacetamide Traditional Name: N-[3-fluoro-4-(4-phenylpiperazino)phenyl]-2-[(4-methoxyphenyl)thio]acetamide Formula: C25H26FN3O2S MolecularWeight: 451.556243

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)SCC(=O)NC2=CC(=C(C=C2)N3CCN(CC3)C4=CC=CC=C4)F

Isomeric SMILES

COC1=CC=C(C=C1)SCC(=O)NC2=CC(=C(C=C2)N3CCN(CC3)C4=CC=CC=C4)F

InChI

InChI=1S/C25H26FN3O2S/c1-31-21-8-10-22(11-9-21)32-18-25(30)27-19-7-12-24(23(26)17-19)29-15-13-28(14-16-29)20-5-3-2-4-6-20/h2-12,17H,13-16,18H2,1H3,(H,27,30)