1-(4-chlorophenyl)-N5-(4-cyanophenyl)-N3-(phenylmethyl)pyrazole-3,5-dicarboxamide

Systemtic Name: 1-(4-chlorophenyl)-N5-(4-cyanophenyl)-N3-(phenylmethyl)pyrazole-3,5-dicarboxamide Openeye Name: N3-benzyl-1-(4-chlorophenyl)-N5-(4-cyanophenyl)pyrazole-3,5-dicarboxamide CAS Name: 1-(4-chlorophenyl)-N5-(4-cyanophenyl)-N3-(phenylmethyl)pyrazole-3,5-dicarboxamide IUPAC Name: 3-N-benzyl-1-(4-chlorophenyl)-5-N-(4-cyanophenyl)pyrazole-3,5-dicarboxamide Traditional Name: N-benzyl-1-(4-chlorophenyl)-N'-(4-cyanophenyl)pyrazole-3,5-dicarboxamide Formula: C25H18ClN5O2 MolecularWeight: 455.89572

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=O)C2=NN(C(=C2)C(=O)NC3=CC=C(C=C3)C#N)C4=CC=C(C=C4)Cl

Isomeric SMILES

C1=CC=C(C=C1)CNC(=O)C2=NN(C(=C2)C(=O)NC3=CC=C(C=C3)C#N)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C25H18ClN5O2/c26-19-8-12-21(13-9-19)31-23(25(33)29-20-10-6-17(15-27)7-11-20)14-22(30-31)24(32)28-16-18-4-2-1-3-5-18/h1-14H,16H2,(H,28,32)(H,29,33)