N-(2-cyanoethyl)-2-(4-fluorophenyl)-5-(4-methoxyphenyl)-N-(pyridin-3-ylmethyl)pyrazole-3-carboxamide

Systemtic Name: N-(2-cyanoethyl)-2-(4-fluorophenyl)-5-(4-methoxyphenyl)-N-(pyridin-3-ylmethyl)pyrazole-3-carboxamide Openeye Name: N-(2-cyanoethyl)-2-(4-fluorophenyl)-5-(4-methoxyphenyl)-N-(3-pyridylmethyl)pyrazole-3-carboxamide CAS Name: N-(2-cyanoethyl)-2-(4-fluorophenyl)-5-(4-methoxyphenyl)-N-(3-pyridinylmethyl)-3-pyrazolecarboxamide IUPAC Name: N-(2-cyanoethyl)-2-(4-fluorophenyl)-5-(4-methoxyphenyl)-N-(pyridin-3-ylmethyl)pyrazole-3-carboxamide Traditional Name: N-(2-cyanoethyl)-2-(4-fluorophenyl)-5-(4-methoxyphenyl)-N-(3-pyridylmethyl)pyrazole-3-carboxamide Formula: C26H22FN5O2 MolecularWeight: 455.483583

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NN(C(=C2)C(=O)N(CCC#N)CC3=CN=CC=C3)C4=CC=C(C=C4)F

Isomeric SMILES

COC1=CC=C(C=C1)C2=NN(C(=C2)C(=O)N(CCC#N)CC3=CN=CC=C3)C4=CC=C(C=C4)F

InChI

InChI=1S/C26H22FN5O2/c1-34-23-11-5-20(6-12-23)24-16-25(32(30-24)22-9-7-21(27)8-10-22)26(33)31(15-3-13-28)18-19-4-2-14-29-17-19/h2,4-12,14,16-17H,3,15,18H2,1H3