2-[(2-chloranyl-6-fluoranyl-7-morpholin-4-yl-4-oxidanylidene-quinazolin-3-yl)methyl]benzenecarbonitrile

Systemtic Name: 2-[(2-chloranyl-6-fluoranyl-7-morpholin-4-yl-4-oxidanylidene-quinazolin-3-yl)methyl]benzenecarbonitrile Openeye Name: 2-[(2-chloro-6-fluoro-7-morpholino-4-oxo-quinazolin-3-yl)methyl]benzonitrile CAS Name: 2-[[2-chloro-6-fluoro-7-(4-morpholinyl)-4-oxo-3-quinazolinyl]methyl]benzonitrile IUPAC Name: 2-[(2-chloro-6-fluoro-7-morpholin-4-yl-4-oxoquinazolin-3-yl)methyl]benzonitrile Traditional Name: 2-[(2-chloro-6-fluoro-4-keto-7-morpholino-quinazolin-3-yl)methyl]benzonitrile Formula: C20H16ClFN4O2 MolecularWeight: 398.818043

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=C(C=C3C(=C2)N=C(N(C3=O)CC4=CC=CC=C4C#N)Cl)F

Isomeric SMILES

C1COCCN1C2=C(C=C3C(=C2)N=C(N(C3=O)CC4=CC=CC=C4C#N)Cl)F

InChI

InChI=1S/C20H16ClFN4O2/c21-20-24-17-10-18(25-5-7-28-8-6-25)16(22)9-15(17)19(27)26(20)12-14-4-2-1-3-13(14)11-23/h1-4,9-10H,5-8,12H2