2-[(E)-2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)ethenyl]-1H-quinazolin-4-one

Systemtic Name: 2-[(E)-2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)ethenyl]-1H-quinazolin-4-one Openeye Name: 2-[(E)-2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)vinyl]-1H-quinazolin-4-one CAS Name: 2-[(E)-2-(3,5-dimethyl-1-phenyl-4-pyrazolyl)ethenyl]-1H-quinazolin-4-one IUPAC Name: 2-[(E)-2-(3,5-dimethyl-1-phenylpyrazol-4-yl)ethenyl]-1H-quinazolin-4-one Traditional Name: 2-[(E)-2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)vinyl]-1H-quinazolin-4-one Formula: C21H18N4O MolecularWeight: 342.39382

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)C=CC3=NC(=O)C4=CC=CC=C4N3

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)/C=C/C3=NC(=O)C4=CC=CC=C4N3

InChI

InChI=1S/C21H18N4O/c1-14-17(15(2)25(24-14)16-8-4-3-5-9-16)12-13-20-22-19-11-7-6-10-18(19)21(26)23-20/h3-13H,1-2H3,(H,22,23,26)/b13-12+