3-(3,4-dimethoxyphenyl)-N-[(E)-pyridin-2-ylmethylideneamino]-1H-pyrazole-5-carboxamide

Systemtic Name: 3-(3,4-dimethoxyphenyl)-N-[(E)-pyridin-2-ylmethylideneamino]-1H-pyrazole-5-carboxamide Openeye Name: 3-(3,4-dimethoxyphenyl)-N-[(E)-2-pyridylmethyleneamino]-1H-pyrazole-5-carboxamide CAS Name: 3-(3,4-dimethoxyphenyl)-N-[(E)-2-pyridinylmethylideneamino]-1H-pyrazole-5-carboxamide IUPAC Name: 3-(3,4-dimethoxyphenyl)-N-[(E)-pyridin-2-ylmethylideneamino]-1H-pyrazole-5-carboxamide Traditional Name: 3-(3,4-dimethoxyphenyl)-N-[(E)-2-pyridylmethyleneamino]-1H-pyrazole-5-carboxamide Formula: C18H17N5O3 MolecularWeight: 351.35928

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NNC(=C2)C(=O)NN=CC3=CC=CC=N3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NNC(=C2)C(=O)N/N=C/C3=CC=CC=N3)OC

InChI

InChI=1S/C18H17N5O3/c1-25-16-7-6-12(9-17(16)26-2)14-10-15(22-21-14)18(24)23-20-11-13-5-3-4-8-19-13/h3-11H,1-2H3,(H,21,22)(H,23,24)/b20-11+