1-(4-chlorophenyl)-N-[6-(3-oxidanylidenepiperazin-1-yl)pyridin-3-yl]-5-propan-2-yl-pyrazole-4-carboxamide

Systemtic Name: 1-(4-chlorophenyl)-N-[6-(3-oxidanylidenepiperazin-1-yl)pyridin-3-yl]-5-propan-2-yl-pyrazole-4-carboxamide Openeye Name: 1-(4-chlorophenyl)-5-isopropyl-N-[6-(3-oxopiperazin-1-yl)-3-pyridyl]pyrazole-4-carboxamide CAS Name: 1-(4-chlorophenyl)-N-[6-(3-oxo-1-piperazinyl)-3-pyridinyl]-5-propan-2-yl-4-pyrazolecarboxamide IUPAC Name: 1-(4-chlorophenyl)-N-[6-(3-oxopiperazin-1-yl)pyridin-3-yl]-5-propan-2-ylpyrazole-4-carboxamide Traditional Name: 1-(4-chlorophenyl)-5-isopropyl-N-[6-(3-ketopiperazino)-3-pyridyl]pyrazole-4-carboxamide Formula: C22H23ClN6O2 MolecularWeight: 438.91002

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C=NN1C2=CC=C(C=C2)Cl)C(=O)NC3=CN=C(C=C3)N4CCNC(=O)C4

Isomeric SMILES

CC(C)C1=C(C=NN1C2=CC=C(C=C2)Cl)C(=O)NC3=CN=C(C=C3)N4CCNC(=O)C4

InChI

InChI=1S/C22H23ClN6O2/c1-14(2)21-18(12-26-29(21)17-6-3-15(23)4-7-17)22(31)27-16-5-8-19(25-11-16)28-10-9-24-20(30)13-28/h3-8,11-12,14H,9-10,13H2,1-2H3,(H,24,30)(H,27,31)