N-[2-(5-fluoranyl-1H-indol-3-yl)ethyl]-4-[(2-methylsulfonylphenyl)carbonylamino]piperidine-4-carboxamide

Systemtic Name: N-[2-(5-fluoranyl-1H-indol-3-yl)ethyl]-4-[(2-methylsulfonylphenyl)carbonylamino]piperidine-4-carboxamide Openeye Name: N-[2-(5-fluoro-1H-indol-3-yl)ethyl]-4-[(2-methylsulfonylbenzoyl)amino]piperidine-4-carboxamide CAS Name: N-[2-(5-fluoro-1H-indol-3-yl)ethyl]-4-[[(2-methylsulfonylphenyl)-oxomethyl]amino]-4-piperidinecarboxamide IUPAC Name: N-[2-(5-fluoro-1H-indol-3-yl)ethyl]-4-[(2-methylsulfonylbenzoyl)amino]piperidine-4-carboxamide Traditional Name: N-[2-(5-fluoro-1H-indol-3-yl)ethyl]-4-[(2-mesylbenzoyl)amino]isonipecotamide Formula: C24H27FN4O4S MolecularWeight: 486.558983

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=CC=C1C(=O)NC2(CCNCC2)C(=O)NCCC3=CNC4=C3C=C(C=C4)F

Isomeric SMILES

CS(=O)(=O)C1=CC=CC=C1C(=O)NC2(CCNCC2)C(=O)NCCC3=CNC4=C3C=C(C=C4)F

InChI

InChI=1S/C24H27FN4O4S/c1-34(32,33)21-5-3-2-4-18(21)22(30)29-24(9-12-26-13-10-24)23(31)27-11-8-16-15-28-20-7-6-17(25)14-19(16)20/h2-7,14-15,26,28H,8-13H2,1H3,(H,27,31)(H,29,30)