4-[4-[(4-morpholin-4-ylphenyl)amino]quinazolin-2-yl]benzenecarbonitrile

Systemtic Name: 4-[4-[(4-morpholin-4-ylphenyl)amino]quinazolin-2-yl]benzenecarbonitrile Openeye Name: 4-[4-(4-morpholinoanilino)quinazolin-2-yl]benzonitrile CAS Name: 4-[4-[4-(4-morpholinyl)anilino]-2-quinazolinyl]benzonitrile IUPAC Name: 4-[4-(4-morpholin-4-ylanilino)quinazolin-2-yl]benzonitrile Traditional Name: 4-[4-(4-morpholinoanilino)quinazolin-2-yl]benzonitrile Formula: C25H21N5O MolecularWeight: 407.46714

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=CC=C(C=C2)NC3=NC(=NC4=CC=CC=C43)C5=CC=C(C=C5)C#N

Isomeric SMILES

C1COCCN1C2=CC=C(C=C2)NC3=NC(=NC4=CC=CC=C43)C5=CC=C(C=C5)C#N

InChI

InChI=1S/C25H21N5O/c26-17-18-5-7-19(8-6-18)24-28-23-4-2-1-3-22(23)25(29-24)27-20-9-11-21(12-10-20)30-13-15-31-16-14-30/h1-12H,13-16H2,(H,27,28,29)