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

Systemtic Name: N-(2-cyanoethyl)-5-(4-methoxyphenyl)-2-phenyl-N-(pyridin-3-ylmethyl)pyrazole-3-carboxamide Openeye Name: N-(2-cyanoethyl)-5-(4-methoxyphenyl)-2-phenyl-N-(3-pyridylmethyl)pyrazole-3-carboxamide CAS Name: N-(2-cyanoethyl)-5-(4-methoxyphenyl)-2-phenyl-N-(3-pyridinylmethyl)-3-pyrazolecarboxamide IUPAC Name: N-(2-cyanoethyl)-5-(4-methoxyphenyl)-2-phenyl-N-(pyridin-3-ylmethyl)pyrazole-3-carboxamide Traditional Name: N-(2-cyanoethyl)-5-(4-methoxyphenyl)-2-phenyl-N-(3-pyridylmethyl)pyrazole-3-carboxamide Formula: C26H23N5O2 MolecularWeight: 437.49312

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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=CC=C4

Isomeric SMILES

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

InChI

InChI=1S/C26H23N5O2/c1-33-23-12-10-21(11-13-23)24-17-25(31(29-24)22-8-3-2-4-9-22)26(32)30(16-6-14-27)19-20-7-5-15-28-18-20/h2-5,7-13,15,17-18H,6,16,19H2,1H3