N-[2-(4-fluorophenyl)sulfanyl-5-(4-phenylpiperazin-1-yl)carbonyl-phenyl]ethanamide

Systemtic Name: N-[2-(4-fluorophenyl)sulfanyl-5-(4-phenylpiperazin-1-yl)carbonyl-phenyl]ethanamide Openeye Name: N-[2-(4-fluorophenyl)sulfanyl-5-(4-phenylpiperazine-1-carbonyl)phenyl]acetamide CAS Name: N-[2-[(4-fluorophenyl)thio]-5-[oxo-(4-phenyl-1-piperazinyl)methyl]phenyl]acetamide IUPAC Name: N-[2-(4-fluorophenyl)sulfanyl-5-(4-phenylpiperazine-1-carbonyl)phenyl]acetamide Traditional Name: N-[2-[(4-fluorophenyl)thio]-5-(4-phenylpiperazine-1-carbonyl)phenyl]acetamide Formula: C25H24FN3O2S MolecularWeight: 449.540363

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C=CC(=C1)C(=O)N2CCN(CC2)C3=CC=CC=C3)SC4=CC=C(C=C4)F

Isomeric SMILES

CC(=O)NC1=C(C=CC(=C1)C(=O)N2CCN(CC2)C3=CC=CC=C3)SC4=CC=C(C=C4)F

InChI

InChI=1S/C25H24FN3O2S/c1-18(30)27-23-17-19(7-12-24(23)32-22-10-8-20(26)9-11-22)25(31)29-15-13-28(14-16-29)21-5-3-2-4-6-21/h2-12,17H,13-16H2,1H3,(H,27,30)