2-[(6-chloranylpyridin-3-yl)methyl]-N-[(E)-furan-2-ylmethylideneamino]-5-(4-methoxyphenyl)pyrazole-3-carboxamide

Systemtic Name: 2-[(6-chloranylpyridin-3-yl)methyl]-N-[(E)-furan-2-ylmethylideneamino]-5-(4-methoxyphenyl)pyrazole-3-carboxamide Openeye Name: 2-[(6-chloro-3-pyridyl)methyl]-N-[(E)-2-furylmethyleneamino]-5-(4-methoxyphenyl)pyrazole-3-carboxamide CAS Name: 2-[(6-chloro-3-pyridinyl)methyl]-N-[(E)-2-furanylmethylideneamino]-5-(4-methoxyphenyl)-3-pyrazolecarboxamide IUPAC Name: 2-[(6-chloropyridin-3-yl)methyl]-N-[(E)-furan-2-ylmethylideneamino]-5-(4-methoxyphenyl)pyrazole-3-carboxamide Traditional Name: 2-[(6-chloro-3-pyridyl)methyl]-N-[(E)-2-furfurylideneamino]-5-(4-methoxyphenyl)pyrazole-3-carboxamide Formula: C22H18ClN5O3 MolecularWeight: 435.86302

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NN(C(=C2)C(=O)NN=CC3=CC=CO3)CC4=CN=C(C=C4)Cl

Isomeric SMILES

COC1=CC=C(C=C1)C2=NN(C(=C2)C(=O)N/N=C/C3=CC=CO3)CC4=CN=C(C=C4)Cl

InChI

InChI=1S/C22H18ClN5O3/c1-30-17-7-5-16(6-8-17)19-11-20(22(29)26-25-13-18-3-2-10-31-18)28(27-19)14-15-4-9-21(23)24-12-15/h2-13H,14H2,1H3,(H,26,29)/b25-13+