N-[(3-fluoranyl-4-methyl-phenyl)methyl]-1-(3-thiophen-3-ylpropanoyl)piperidine-4-carboxamide

Systemtic Name: N-[(3-fluoranyl-4-methyl-phenyl)methyl]-1-(3-thiophen-3-ylpropanoyl)piperidine-4-carboxamide Openeye Name: N-[(3-fluoro-4-methyl-phenyl)methyl]-1-[3-(3-thienyl)propanoyl]piperidine-4-carboxamide CAS Name: N-[(3-fluoro-4-methylphenyl)methyl]-1-[1-oxo-3-(3-thiophenyl)propyl]-4-piperidinecarboxamide IUPAC Name: N-[(3-fluoro-4-methylphenyl)methyl]-1-(3-thiophen-3-ylpropanoyl)piperidine-4-carboxamide Traditional Name: N-(3-fluoro-4-methyl-benzyl)-1-[3-(3-thienyl)propanoyl]isonipecotamide Formula: C21H25FN2O2S MolecularWeight: 388.498803

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)CNC(=O)C2CCN(CC2)C(=O)CCC3=CSC=C3)F

Isomeric SMILES

CC1=C(C=C(C=C1)CNC(=O)C2CCN(CC2)C(=O)CCC3=CSC=C3)F

InChI

InChI=1S/C21H25FN2O2S/c1-15-2-3-17(12-19(15)22)13-23-21(26)18-6-9-24(10-7-18)20(25)5-4-16-8-11-27-14-16/h2-3,8,11-12,14,18H,4-7,9-10,13H2,1H3,(H,23,26)