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

Systemtic Name: 4-methoxy-N-[6-(3-oxidanylidenepiperazin-1-yl)pyridin-3-yl]-1-phenyl-pyrazole-3-carboxamide Openeye Name: 4-methoxy-N-[6-(3-oxopiperazin-1-yl)-3-pyridyl]-1-phenyl-pyrazole-3-carboxamide CAS Name: 4-methoxy-N-[6-(3-oxo-1-piperazinyl)-3-pyridinyl]-1-phenyl-3-pyrazolecarboxamide IUPAC Name: 4-methoxy-N-[6-(3-oxopiperazin-1-yl)pyridin-3-yl]-1-phenylpyrazole-3-carboxamide Traditional Name: N-[6-(3-ketopiperazino)-3-pyridyl]-4-methoxy-1-phenyl-pyrazole-3-carboxamide Formula: C20H20N6O3 MolecularWeight: 392.4112

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CN(N=C1C(=O)NC2=CN=C(C=C2)N3CCNC(=O)C3)C4=CC=CC=C4

Isomeric SMILES

COC1=CN(N=C1C(=O)NC2=CN=C(C=C2)N3CCNC(=O)C3)C4=CC=CC=C4

InChI

InChI=1S/C20H20N6O3/c1-29-16-12-26(15-5-3-2-4-6-15)24-19(16)20(28)23-14-7-8-17(22-11-14)25-10-9-21-18(27)13-25/h2-8,11-12H,9-10,13H2,1H3,(H,21,27)(H,23,28)