1-[3-[[4-fluoranyl-3-(phenoxymethyl)-1-benzothiophen-2-yl]carbonylamino]propyl]piperidine-4-carboxamide

Systemtic Name: 1-[3-[[4-fluoranyl-3-(phenoxymethyl)-1-benzothiophen-2-yl]carbonylamino]propyl]piperidine-4-carboxamide Openeye Name: 1-[3-[[4-fluoro-3-(phenoxymethyl)benzothiophene-2-carbonyl]amino]propyl]piperidine-4-carboxamide CAS Name: 1-[3-[[[4-fluoro-3-(phenoxymethyl)-1-benzothiophen-2-yl]-oxomethyl]amino]propyl]-4-piperidinecarboxamide IUPAC Name: 1-[3-[[4-fluoro-3-(phenoxymethyl)-1-benzothiophene-2-carbonyl]amino]propyl]piperidine-4-carboxamide Traditional Name: 1-[3-[[4-fluoro-3-(phenoxymethyl)benzothiophene-2-carbonyl]amino]propyl]isonipecotamide Formula: C25H28FN3O3S MolecularWeight: 469.571523

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)N)CCCNC(=O)C2=C(C3=C(C=CC=C3S2)F)COC4=CC=CC=C4

Isomeric SMILES

C1CN(CCC1C(=O)N)CCCNC(=O)C2=C(C3=C(C=CC=C3S2)F)COC4=CC=CC=C4

InChI

InChI=1S/C25H28FN3O3S/c26-20-8-4-9-21-22(20)19(16-32-18-6-2-1-3-7-18)23(33-21)25(31)28-12-5-13-29-14-10-17(11-15-29)24(27)30/h1-4,6-9,17H,5,10-16H2,(H2,27,30)(H,28,31)