3-(2-butoxyphenyl)-N-[(E)-pyridin-3-ylmethylideneamino]-1H-pyrazole-5-carboxamide

Systemtic Name: 3-(2-butoxyphenyl)-N-[(E)-pyridin-3-ylmethylideneamino]-1H-pyrazole-5-carboxamide Openeye Name: 3-(2-butoxyphenyl)-N-[(E)-3-pyridylmethyleneamino]-1H-pyrazole-5-carboxamide CAS Name: 3-(2-butoxyphenyl)-N-[(E)-3-pyridinylmethylideneamino]-1H-pyrazole-5-carboxamide IUPAC Name: 3-(2-butoxyphenyl)-N-[(E)-pyridin-3-ylmethylideneamino]-1H-pyrazole-5-carboxamide Traditional Name: 3-(2-butoxyphenyl)-N-[(E)-3-pyridylmethyleneamino]-1H-pyrazole-5-carboxamide Formula: C20H21N5O2 MolecularWeight: 363.41304

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=CC=C1C2=NNC(=C2)C(=O)NN=CC3=CN=CC=C3

Isomeric SMILES

CCCCOC1=CC=CC=C1C2=NNC(=C2)C(=O)N/N=C/C3=CN=CC=C3

InChI

InChI=1S/C20H21N5O2/c1-2-3-11-27-19-9-5-4-8-16(19)17-12-18(24-23-17)20(26)25-22-14-15-7-6-10-21-13-15/h4-10,12-14H,2-3,11H2,1H3,(H,23,24)(H,25,26)/b22-14+