4-[2-(6-methoxypyridin-3-yl)-5-(4-methylpiperazin-1-yl)carbonyl-1H-pyrazol-3-ylidene]cyclohexa-2,5-dien-1-one

Systemtic Name: 4-[2-(6-methoxypyridin-3-yl)-5-(4-methylpiperazin-1-yl)carbonyl-1H-pyrazol-3-ylidene]cyclohexa-2,5-dien-1-one Openeye Name: 4-[2-(6-methoxy-3-pyridyl)-5-(4-methylpiperazine-1-carbonyl)-1H-pyrazol-3-ylidene]cyclohexa-2,5-dien-1-one CAS Name: 4-[2-(6-methoxy-3-pyridinyl)-5-[(4-methyl-1-piperazinyl)-oxomethyl]-1H-pyrazol-3-ylidene]-1-cyclohexa-2,5-dienone IUPAC Name: 4-[2-(6-methoxypyridin-3-yl)-5-(4-methylpiperazine-1-carbonyl)-1H-pyrazol-3-ylidene]cyclohexa-2,5-dien-1-one Traditional Name: 4-[2-(6-methoxy-3-pyridyl)-5-(4-methylpiperazine-1-carbonyl)-3-pyrazolin-3-ylidene]cyclohexa-2,5-dien-1-one Formula: C21H23N5O3 MolecularWeight: 393.43902

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C(=O)C2=CC(=C3C=CC(=O)C=C3)N(N2)C4=CN=C(C=C4)OC

Isomeric SMILES

CN1CCN(CC1)C(=O)C2=CC(=C3C=CC(=O)C=C3)N(N2)C4=CN=C(C=C4)OC

InChI

InChI=1S/C21H23N5O3/c1-24-9-11-25(12-10-24)21(28)18-13-19(15-3-6-17(27)7-4-15)26(23-18)16-5-8-20(29-2)22-14-16/h3-8,13-14,23H,9-12H2,1-2H3