3,5-dimethyl-N-[6-(3-oxidanylidenepiperazin-1-yl)pyridin-3-yl]-1-phenyl-pyrazole-4-carboxamide

Systemtic Name: 3,5-dimethyl-N-[6-(3-oxidanylidenepiperazin-1-yl)pyridin-3-yl]-1-phenyl-pyrazole-4-carboxamide Openeye Name: 3,5-dimethyl-N-[6-(3-oxopiperazin-1-yl)-3-pyridyl]-1-phenyl-pyrazole-4-carboxamide CAS Name: 3,5-dimethyl-N-[6-(3-oxo-1-piperazinyl)-3-pyridinyl]-1-phenyl-4-pyrazolecarboxamide IUPAC Name: 3,5-dimethyl-N-[6-(3-oxopiperazin-1-yl)pyridin-3-yl]-1-phenylpyrazole-4-carboxamide Traditional Name: N-[6-(3-ketopiperazino)-3-pyridyl]-3,5-dimethyl-1-phenyl-pyrazole-4-carboxamide Formula: C21H22N6O2 MolecularWeight: 390.43838

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)C(=O)NC3=CN=C(C=C3)N4CCNC(=O)C4

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)C(=O)NC3=CN=C(C=C3)N4CCNC(=O)C4

InChI

InChI=1S/C21H22N6O2/c1-14-20(15(2)27(25-14)17-6-4-3-5-7-17)21(29)24-16-8-9-18(23-12-16)26-11-10-22-19(28)13-26/h3-9,12H,10-11,13H2,1-2H3,(H,22,28)(H,24,29)