3-[(3-methyl-5-oxidanylidene-1-phenyl-pyrazol-4-ylidene)methylamino]-2-(phenoxymethyl)quinazolin-4-one

Systemtic Name: 3-[(3-methyl-5-oxidanylidene-1-phenyl-pyrazol-4-ylidene)methylamino]-2-(phenoxymethyl)quinazolin-4-one Openeye Name: 3-[(3-methyl-5-oxo-1-phenyl-pyrazol-4-ylidene)methylamino]-2-(phenoxymethyl)quinazolin-4-one CAS Name: 3-[(3-methyl-5-oxo-1-phenyl-4-pyrazolylidene)methylamino]-2-(phenoxymethyl)-4-quinazolinone IUPAC Name: 3-[(3-methyl-5-oxo-1-phenylpyrazol-4-ylidene)methylamino]-2-(phenoxymethyl)quinazolin-4-one Traditional Name: 3-[(5-keto-3-methyl-1-phenyl-2-pyrazolin-4-ylidene)methylamino]-2-(phenoxymethyl)quinazolin-4-one Formula: C26H21N5O3 MolecularWeight: 451.47664

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1=CNN2C(=NC3=CC=CC=C3C2=O)COC4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CC1=NN(C(=O)C1=CNN2C(=NC3=CC=CC=C3C2=O)COC4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C26H21N5O3/c1-18-22(26(33)30(29-18)19-10-4-2-5-11-19)16-27-31-24(17-34-20-12-6-3-7-13-20)28-23-15-9-8-14-21(23)25(31)32/h2-16,27H,17H2,1H3