N-(3-acetamido-4-fluoranyl-phenyl)-1-(4-methylphenyl)-6-oxidanylidene-2-thiophen-2-yl-piperidine-3-carboxamide

Systemtic Name: N-(3-acetamido-4-fluoranyl-phenyl)-1-(4-methylphenyl)-6-oxidanylidene-2-thiophen-2-yl-piperidine-3-carboxamide Openeye Name: N-(3-acetamido-4-fluoro-phenyl)-6-oxo-1-(p-tolyl)-2-(2-thienyl)piperidine-3-carboxamide CAS Name: N-(3-acetamido-4-fluorophenyl)-1-(4-methylphenyl)-6-oxo-2-thiophen-2-yl-3-piperidinecarboxamide IUPAC Name: N-(3-acetamido-4-fluorophenyl)-1-(4-methylphenyl)-6-oxo-2-thiophen-2-ylpiperidine-3-carboxamide Traditional Name: N-(3-acetamido-4-fluoro-phenyl)-6-keto-1-(p-tolyl)-2-(2-thienyl)nipecotamide Formula: C25H24FN3O3S MolecularWeight: 465.539763

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(C(CCC2=O)C(=O)NC3=CC(=C(C=C3)F)NC(=O)C)C4=CC=CS4

Isomeric SMILES

CC1=CC=C(C=C1)N2C(C(CCC2=O)C(=O)NC3=CC(=C(C=C3)F)NC(=O)C)C4=CC=CS4

InChI

InChI=1S/C25H24FN3O3S/c1-15-5-8-18(9-6-15)29-23(31)12-10-19(24(29)22-4-3-13-33-22)25(32)28-17-7-11-20(26)21(14-17)27-16(2)30/h3-9,11,13-14,19,24H,10,12H2,1-2H3,(H,27,30)(H,28,32)