2-[(2-methylphenoxy)methyl]-3-[[3-(4-methylphenyl)pyrazol-4-ylidene]methylamino]quinazolin-4-one

Systemtic Name: 2-[(2-methylphenoxy)methyl]-3-[[3-(4-methylphenyl)pyrazol-4-ylidene]methylamino]quinazolin-4-one Openeye Name: 2-[(2-methylphenoxy)methyl]-3-[[3-(p-tolyl)pyrazol-4-ylidene]methylamino]quinazolin-4-one CAS Name: 2-[(2-methylphenoxy)methyl]-3-[[3-(4-methylphenyl)-4-pyrazolylidene]methylamino]-4-quinazolinone IUPAC Name: 2-[(2-methylphenoxy)methyl]-3-[[3-(4-methylphenyl)pyrazol-4-ylidene]methylamino]quinazolin-4-one Traditional Name: 2-[(2-methylphenoxy)methyl]-3-[[3-(p-tolyl)pyrazol-4-ylidene]methylamino]quinazolin-4-one Formula: C27H23N5O2 MolecularWeight: 449.50382

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN=CC2=CNN3C(=NC4=CC=CC=C4C3=O)COC5=CC=CC=C5C

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN=CC2=CNN3C(=NC4=CC=CC=C4C3=O)COC5=CC=CC=C5C

InChI

InChI=1S/C27H23N5O2/c1-18-11-13-20(14-12-18)26-21(15-28-31-26)16-29-32-25(17-34-24-10-6-3-7-19(24)2)30-23-9-5-4-8-22(23)27(32)33/h3-16,29H,17H2,1-2H3