4-[(Z)-[3-(piperidin-1-ylmethyl)-4,5,6,7-tetrahydroindol-2-ylidene]methyl]-5-pyrimidin-5-yl-1,2-dihydropyrazol-3-one

Systemtic Name: 4-[(Z)-[3-(piperidin-1-ylmethyl)-4,5,6,7-tetrahydroindol-2-ylidene]methyl]-5-pyrimidin-5-yl-1,2-dihydropyrazol-3-one Openeye Name: 4-[(Z)-[3-(1-piperidylmethyl)-4,5,6,7-tetrahydroindol-2-ylidene]methyl]-5-pyrimidin-5-yl-1,2-dihydropyrazol-3-one CAS Name: 4-[(Z)-[3-(1-piperidinylmethyl)-4,5,6,7-tetrahydroindol-2-ylidene]methyl]-5-(5-pyrimidinyl)-1,2-dihydropyrazol-3-one IUPAC Name: 4-[(Z)-[3-(piperidin-1-ylmethyl)-4,5,6,7-tetrahydroindol-2-ylidene]methyl]-5-pyrimidin-5-yl-1,2-dihydropyrazol-3-one Traditional Name: 4-[(Z)-[3-(piperidinomethyl)-4,5,6,7-tetrahydroindol-2-ylidene]methyl]-5-(5-pyrimidyl)-3-pyrazolin-3-one Formula: C22H26N6O MolecularWeight: 390.48144

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CC2=C3CCCCC3=NC2=CC4=C(NNC4=O)C5=CN=CN=C5

Isomeric SMILES

C1CCN(CC1)CC\2=C3CCCCC3=N/C2=C\C4=C(NNC4=O)C5=CN=CN=C5

InChI

InChI=1S/C22H26N6O/c29-22-17(21(26-27-22)15-11-23-14-24-12-15)10-20-18(13-28-8-4-1-5-9-28)16-6-2-3-7-19(16)25-20/h10-12,14H,1-9,13H2,(H2,26,27,29)/b20-10-