N-[2-[2,5-bis(chloranyl)phenyl]-5-tert-butyl-pyrazol-3-yl]-3-cyano-benzamide

Systemtic Name: N-[2-[2,5-bis(chloranyl)phenyl]-5-tert-butyl-pyrazol-3-yl]-3-cyano-benzamide Openeye Name: N-[5-tert-butyl-2-(2,5-dichlorophenyl)pyrazol-3-yl]-3-cyano-benzamide CAS Name: N-[5-tert-butyl-2-(2,5-dichlorophenyl)-3-pyrazolyl]-3-cyanobenzamide IUPAC Name: N-[5-tert-butyl-2-(2,5-dichlorophenyl)pyrazol-3-yl]-3-cyanobenzamide Traditional Name: N-[5-tert-butyl-2-(2,5-dichlorophenyl)pyrazol-3-yl]-3-cyano-benzamide Formula: C21H18Cl2N4O MolecularWeight: 413.29982

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NN(C(=C1)NC(=O)C2=CC=CC(=C2)C#N)C3=C(C=CC(=C3)Cl)Cl

Isomeric SMILES

CC(C)(C)C1=NN(C(=C1)NC(=O)C2=CC=CC(=C2)C#N)C3=C(C=CC(=C3)Cl)Cl

InChI

InChI=1S/C21H18Cl2N4O/c1-21(2,3)18-11-19(25-20(28)14-6-4-5-13(9-14)12-24)27(26-18)17-10-15(22)7-8-16(17)23/h4-11H,1-3H3,(H,25,28)