3-[4-(2-morpholin-4-ylethylamino)quinazolin-6-yl]benzenecarbonitrile

Systemtic Name: 3-[4-(2-morpholin-4-ylethylamino)quinazolin-6-yl]benzenecarbonitrile Openeye Name: 3-[4-(2-morpholinoethylamino)quinazolin-6-yl]benzonitrile CAS Name: 3-[4-[2-(4-morpholinyl)ethylamino]-6-quinazolinyl]benzonitrile IUPAC Name: 3-[4-(2-morpholin-4-ylethylamino)quinazolin-6-yl]benzonitrile Traditional Name: 3-[4-(2-morpholinoethylamino)quinazolin-6-yl]benzonitrile Formula: C21H21N5O MolecularWeight: 359.42434

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CCNC2=NC=NC3=C2C=C(C=C3)C4=CC=CC(=C4)C#N

Isomeric SMILES

C1COCCN1CCNC2=NC=NC3=C2C=C(C=C3)C4=CC=CC(=C4)C#N

InChI

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