2-[[3-[(3-oxidanylidenemorpholin-4-yl)methyl]phenyl]amino]quinazoline-6-carbonitrile

Systemtic Name: 2-[[3-[(3-oxidanylidenemorpholin-4-yl)methyl]phenyl]amino]quinazoline-6-carbonitrile Openeye Name: 2-[3-[(3-oxomorpholin-4-yl)methyl]anilino]quinazoline-6-carbonitrile CAS Name: 2-[3-[(3-oxo-4-morpholinyl)methyl]anilino]-6-quinazolinecarbonitrile IUPAC Name: 2-[3-[(3-oxomorpholin-4-yl)methyl]anilino]quinazoline-6-carbonitrile Traditional Name: 2-[3-[(3-ketomorpholino)methyl]anilino]quinazoline-6-carbonitrile Formula: C20H17N5O2 MolecularWeight: 359.38128

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC(=O)N1CC2=CC(=CC=C2)NC3=NC=C4C=C(C=CC4=N3)C#N

Isomeric SMILES

C1COCC(=O)N1CC2=CC(=CC=C2)NC3=NC=C4C=C(C=CC4=N3)C#N

InChI

InChI=1S/C20H17N5O2/c21-10-14-4-5-18-16(8-14)11-22-20(24-18)23-17-3-1-2-15(9-17)12-25-6-7-27-13-19(25)26/h1-5,8-9,11H,6-7,12-13H2,(H,22,23,24)