N-[2-[[2-(2-cyanoethyl)-5-phenyl-pyrazol-3-yl]amino]phenyl]-4-methoxy-benzamide

Systemtic Name: N-[2-[[2-(2-cyanoethyl)-5-phenyl-pyrazol-3-yl]amino]phenyl]-4-methoxy-benzamide Openeye Name: N-[2-[[2-(2-cyanoethyl)-5-phenyl-pyrazol-3-yl]amino]phenyl]-4-methoxy-benzamide CAS Name: N-[2-[[2-(2-cyanoethyl)-5-phenyl-3-pyrazolyl]amino]phenyl]-4-methoxybenzamide IUPAC Name: N-[2-[[2-(2-cyanoethyl)-5-phenylpyrazol-3-yl]amino]phenyl]-4-methoxybenzamide Traditional Name: N-[2-[[2-(2-cyanoethyl)-5-phenyl-pyrazol-3-yl]amino]phenyl]-4-methoxy-benzamide Formula: C26H23N5O2 MolecularWeight: 437.49312

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)NC2=CC=CC=C2NC3=CC(=NN3CCC#N)C4=CC=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)NC2=CC=CC=C2NC3=CC(=NN3CCC#N)C4=CC=CC=C4

InChI

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