4-(2-chlorophenyl)-N-[(1-phenylpyrazol-4-yl)methyl]piperazine-1-carboxamide

Systemtic Name: 4-(2-chlorophenyl)-N-[(1-phenylpyrazol-4-yl)methyl]piperazine-1-carboxamide Openeye Name: 4-(2-chlorophenyl)-N-[(1-phenylpyrazol-4-yl)methyl]piperazine-1-carboxamide CAS Name: 4-(2-chlorophenyl)-N-[(1-phenyl-4-pyrazolyl)methyl]-1-piperazinecarboxamide IUPAC Name: 4-(2-chlorophenyl)-N-[(1-phenylpyrazol-4-yl)methyl]piperazine-1-carboxamide Traditional Name: 4-(2-chlorophenyl)-N-[(1-phenylpyrazol-4-yl)methyl]piperazine-1-carboxamide Formula: C21H22ClN5O MolecularWeight: 395.88528

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2Cl)C(=O)NCC3=CN(N=C3)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2Cl)C(=O)NCC3=CN(N=C3)C4=CC=CC=C4

InChI

InChI=1S/C21H22ClN5O/c22-19-8-4-5-9-20(19)25-10-12-26(13-11-25)21(28)23-14-17-15-24-27(16-17)18-6-2-1-3-7-18/h1-9,15-16H,10-14H2,(H,23,28)