2-[4-(2-morpholin-4-ylethylamino)quinazolin-2-yl]benzenecarbonitrile

Systemtic Name: 2-[4-(2-morpholin-4-ylethylamino)quinazolin-2-yl]benzenecarbonitrile Openeye Name: 2-[4-(2-morpholinoethylamino)quinazolin-2-yl]benzonitrile CAS Name: 2-[4-[2-(4-morpholinyl)ethylamino]-2-quinazolinyl]benzonitrile IUPAC Name: 2-[4-(2-morpholin-4-ylethylamino)quinazolin-2-yl]benzonitrile Traditional Name: 2-[4-(2-morpholinoethylamino)quinazolin-2-yl]benzonitrile Formula: C21H21N5O MolecularWeight: 359.42434

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CCNC2=NC(=NC3=CC=CC=C32)C4=CC=CC=C4C#N

Isomeric SMILES

C1COCCN1CCNC2=NC(=NC3=CC=CC=C32)C4=CC=CC=C4C#N

InChI

InChI=1S/C21H21N5O/c22-15-16-5-1-2-6-17(16)21-24-19-8-4-3-7-18(19)20(25-21)23-9-10-26-11-13-27-14-12-26/h1-8H,9-14H2,(H,23,24,25)