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

Systemtic Name: 3-[[3-(4-bromophenyl)pyrazol-4-ylidene]methylamino]-2-[(2-methylphenoxy)methyl]quinazolin-4-one Openeye Name: 3-[[3-(4-bromophenyl)pyrazol-4-ylidene]methylamino]-2-[(2-methylphenoxy)methyl]quinazolin-4-one CAS Name: 3-[[3-(4-bromophenyl)-4-pyrazolylidene]methylamino]-2-[(2-methylphenoxy)methyl]-4-quinazolinone IUPAC Name: 3-[[3-(4-bromophenyl)pyrazol-4-ylidene]methylamino]-2-[(2-methylphenoxy)methyl]quinazolin-4-one Traditional Name: 3-[[3-(4-bromophenyl)pyrazol-4-ylidene]methylamino]-2-[(2-methylphenoxy)methyl]quinazolin-4-one Formula: C26H20BrN5O2 MolecularWeight: 514.3733

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1OCC2=NC3=CC=CC=C3C(=O)N2NC=C4C=NN=C4C5=CC=C(C=C5)Br

Isomeric SMILES

CC1=CC=CC=C1OCC2=NC3=CC=CC=C3C(=O)N2NC=C4C=NN=C4C5=CC=C(C=C5)Br

InChI

InChI=1S/C26H20BrN5O2/c1-17-6-2-5-9-23(17)34-16-24-30-22-8-4-3-7-21(22)26(33)32(24)29-15-19-14-28-31-25(19)18-10-12-20(27)13-11-18/h2-15,29H,16H2,1H3