N-[[1-[(2-chlorophenyl)methyl]-3-phenyl-pyrazol-4-yl]methyl]-4-cyano-N-methyl-benzamide

Systemtic Name: N-[[1-[(2-chlorophenyl)methyl]-3-phenyl-pyrazol-4-yl]methyl]-4-cyano-N-methyl-benzamide Openeye Name: N-[[1-[(2-chlorophenyl)methyl]-3-phenyl-pyrazol-4-yl]methyl]-4-cyano-N-methyl-benzamide CAS Name: N-[[1-[(2-chlorophenyl)methyl]-3-phenyl-4-pyrazolyl]methyl]-4-cyano-N-methylbenzamide IUPAC Name: N-[[1-[(2-chlorophenyl)methyl]-3-phenylpyrazol-4-yl]methyl]-4-cyano-N-methylbenzamide Traditional Name: N-[[1-(2-chlorobenzyl)-3-phenyl-pyrazol-4-yl]methyl]-4-cyano-N-methyl-benzamide Formula: C26H21ClN4O MolecularWeight: 440.92414

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CN(N=C1C2=CC=CC=C2)CC3=CC=CC=C3Cl)C(=O)C4=CC=C(C=C4)C#N

Isomeric SMILES

CN(CC1=CN(N=C1C2=CC=CC=C2)CC3=CC=CC=C3Cl)C(=O)C4=CC=C(C=C4)C#N

InChI

InChI=1S/C26H21ClN4O/c1-30(26(32)21-13-11-19(15-28)12-14-21)16-23-18-31(17-22-9-5-6-10-24(22)27)29-25(23)20-7-3-2-4-8-20/h2-14,18H,16-17H2,1H3