5-(4-bromophenyl)-4-cyano-1-(2,4-dichlorophenyl)-N-piperidin-1-yl-pyrazole-3-carboxamide

Systemtic Name: 5-(4-bromophenyl)-4-cyano-1-(2,4-dichlorophenyl)-N-piperidin-1-yl-pyrazole-3-carboxamide Openeye Name: 5-(4-bromophenyl)-4-cyano-1-(2,4-dichlorophenyl)-N-(1-piperidyl)pyrazole-3-carboxamide CAS Name: 5-(4-bromophenyl)-4-cyano-1-(2,4-dichlorophenyl)-N-(1-piperidinyl)-3-pyrazolecarboxamide IUPAC Name: 5-(4-bromophenyl)-4-cyano-1-(2,4-dichlorophenyl)-N-piperidin-1-ylpyrazole-3-carboxamide Traditional Name: 5-(4-bromophenyl)-4-cyano-1-(2,4-dichlorophenyl)-N-piperidino-pyrazole-3-carboxamide Formula: C22H18BrCl2N5O MolecularWeight: 519.22122

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)NC(=O)C2=NN(C(=C2C#N)C3=CC=C(C=C3)Br)C4=C(C=C(C=C4)Cl)Cl

Isomeric SMILES

C1CCN(CC1)NC(=O)C2=NN(C(=C2C#N)C3=CC=C(C=C3)Br)C4=C(C=C(C=C4)Cl)Cl

InChI

InChI=1S/C22H18BrCl2N5O/c23-15-6-4-14(5-7-15)21-17(13-26)20(22(31)28-29-10-2-1-3-11-29)27-30(21)19-9-8-16(24)12-18(19)25/h4-9,12H,1-3,10-11H2,(H,28,31)