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

Systemtic Name: N-[2-(5-fluoranyl-1H-indol-3-yl)ethyl]-4-[(5-nitrothiophen-3-yl)carbonylamino]piperidine-4-carboxamide Openeye Name: N-[2-(5-fluoro-1H-indol-3-yl)ethyl]-4-[(5-nitrothiophene-3-carbonyl)amino]piperidine-4-carboxamide CAS Name: N-[2-(5-fluoro-1H-indol-3-yl)ethyl]-4-[[(5-nitro-3-thiophenyl)-oxomethyl]amino]-4-piperidinecarboxamide IUPAC Name: N-[2-(5-fluoro-1H-indol-3-yl)ethyl]-4-[(5-nitrothiophene-3-carbonyl)amino]piperidine-4-carboxamide Traditional Name: N-[2-(5-fluoro-1H-indol-3-yl)ethyl]-4-[(5-nitrothiophene-3-carbonyl)amino]isonipecotamide Formula: C21H22FN5O4S MolecularWeight: 459.493883

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC1(C(=O)NCCC2=CNC3=C2C=C(C=C3)F)NC(=O)C4=CSC(=C4)[N+](=O)[O-]

Isomeric SMILES

C1CNCCC1(C(=O)NCCC2=CNC3=C2C=C(C=C3)F)NC(=O)C4=CSC(=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H22FN5O4S/c22-15-1-2-17-16(10-15)13(11-25-17)3-6-24-20(29)21(4-7-23-8-5-21)26-19(28)14-9-18(27(30)31)32-12-14/h1-2,9-12,23,25H,3-8H2,(H,24,29)(H,26,28)