N-(3-ethynylphenyl)-1-(2-fluorophenyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-(3-ethynylphenyl)-1-(2-fluorophenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-(3-ethynylphenyl)-1-(2-fluorophenyl)sulfonyl-piperidine-4-carboxamide CAS Name: N-(3-ethynylphenyl)-1-(2-fluorophenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-(3-ethynylphenyl)-1-(2-fluorophenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-(3-ethynylphenyl)-1-(2-fluorophenyl)sulfonyl-isonipecotamide Formula: C20H19FN2O3S MolecularWeight: 386.439863

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Descriptors Computed from Structure

Canonical SMILES:

C#CC1=CC(=CC=C1)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CC=C3F

Isomeric SMILES

C#CC1=CC(=CC=C1)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CC=C3F

InChI

InChI=1S/C20H19FN2O3S/c1-2-15-6-5-7-17(14-15)22-20(24)16-10-12-23(13-11-16)27(25,26)19-9-4-3-8-18(19)21/h1,3-9,14,16H,10-13H2,(H,22,24)