N-[(3Z)-3-(5-ethoxy-6-fluoranyl-benzimidazol-2-ylidene)-1,2-dihydropyrazol-4-yl]piperidine-4-carboxamide

Systemtic Name: N-[(3Z)-3-(5-ethoxy-6-fluoranyl-benzimidazol-2-ylidene)-1,2-dihydropyrazol-4-yl]piperidine-4-carboxamide Openeye Name: N-[(3Z)-3-(5-ethoxy-6-fluoro-benzimidazol-2-ylidene)-1,2-dihydropyrazol-4-yl]piperidine-4-carboxamide CAS Name: N-[(3Z)-3-(5-ethoxy-6-fluoro-2-benzimidazolylidene)-1,2-dihydropyrazol-4-yl]-4-piperidinecarboxamide IUPAC Name: N-[(3Z)-3-(5-ethoxy-6-fluorobenzimidazol-2-ylidene)-1,2-dihydropyrazol-4-yl]piperidine-4-carboxamide Traditional Name: N-[(3Z)-3-(5-ethoxy-6-fluoro-benzimidazol-2-ylidene)-3-pyrazolin-4-yl]isonipecotamide Formula: C18H21FN6O2 MolecularWeight: 372.396743

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=NC(=C3C(=CNN3)NC(=O)C4CCNCC4)N=C2C=C1F

Isomeric SMILES

CCOC1=CC2=N/C(=C/3\C(=CNN3)NC(=O)C4CCNCC4)/N=C2C=C1F

InChI

InChI=1S/C18H21FN6O2/c1-2-27-15-8-13-12(7-11(15)19)22-17(23-13)16-14(9-21-25-16)24-18(26)10-3-5-20-6-4-10/h7-10,20-21,25H,2-6H2,1H3,(H,24,26)/b17-16+