3-[4-[(2,4-dimethoxyphenyl)methylamino]quinazolin-6-yl]benzenecarbonitrile

Systemtic Name: 3-[4-[(2,4-dimethoxyphenyl)methylamino]quinazolin-6-yl]benzenecarbonitrile Openeye Name: 3-[4-[(2,4-dimethoxyphenyl)methylamino]quinazolin-6-yl]benzonitrile CAS Name: 3-[4-[(2,4-dimethoxyphenyl)methylamino]-6-quinazolinyl]benzonitrile IUPAC Name: 3-[4-[(2,4-dimethoxyphenyl)methylamino]quinazolin-6-yl]benzonitrile Traditional Name: 3-[4-[(2,4-dimethoxybenzyl)amino]quinazolin-6-yl]benzonitrile Formula: C24H20N4O2 MolecularWeight: 396.4412

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)CNC2=NC=NC3=C2C=C(C=C3)C4=CC=CC(=C4)C#N)OC

Isomeric SMILES

COC1=CC(=C(C=C1)CNC2=NC=NC3=C2C=C(C=C3)C4=CC=CC(=C4)C#N)OC

InChI

InChI=1S/C24H20N4O2/c1-29-20-8-6-19(23(12-20)30-2)14-26-24-21-11-18(7-9-22(21)27-15-28-24)17-5-3-4-16(10-17)13-25/h3-12,15H,14H2,1-2H3,(H,26,27,28)