4-[5,7-diethyl-3-(3-hydroxyphenyl)-1H-pyrazolo[1,5-a]pyrimidin-2-ylidene]cyclohexa-2,5-dien-1-one

Systemtic Name: 4-[5,7-diethyl-3-(3-hydroxyphenyl)-1H-pyrazolo[1,5-a]pyrimidin-2-ylidene]cyclohexa-2,5-dien-1-one Openeye Name: 4-[5,7-diethyl-3-(3-hydroxyphenyl)-1H-pyrazolo[1,5-a]pyrimidin-2-ylidene]cyclohexa-2,5-dien-1-one CAS Name: 4-[5,7-diethyl-3-(3-hydroxyphenyl)-1H-pyrazolo[1,5-a]pyrimidin-2-ylidene]-1-cyclohexa-2,5-dienone IUPAC Name: 4-[5,7-diethyl-3-(3-hydroxyphenyl)-1H-pyrazolo[1,5-a]pyrimidin-2-ylidene]cyclohexa-2,5-dien-1-one Traditional Name: 4-[5,7-diethyl-3-(3-hydroxyphenyl)-1H-pyrazolo[1,5-a]pyrimidin-2-ylidene]cyclohexa-2,5-dien-1-one Formula: C22H21N3O2 MolecularWeight: 359.42104

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=NC2=C(C(=C3C=CC(=O)C=C3)NN12)C4=CC(=CC=C4)O)CC

Isomeric SMILES

CCC1=CC(=NC2=C(C(=C3C=CC(=O)C=C3)NN12)C4=CC(=CC=C4)O)CC

InChI

InChI=1S/C22H21N3O2/c1-3-16-13-17(4-2)25-22(23-16)20(15-6-5-7-19(27)12-15)21(24-25)14-8-10-18(26)11-9-14/h5-13,24,27H,3-4H2,1-2H3