4-fluoranyl-3-[[methyl-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]amino]methyl]benzenecarbonitrile

Systemtic Name: 4-fluoranyl-3-[[methyl-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]amino]methyl]benzenecarbonitrile Openeye Name: 4-fluoro-3-[[methyl-[(4-oxo-1H-quinazolin-2-yl)methyl]amino]methyl]benzonitrile CAS Name: 4-fluoro-3-[[methyl-[(4-oxo-1H-quinazolin-2-yl)methyl]amino]methyl]benzonitrile IUPAC Name: 4-fluoro-3-[[methyl-[(4-oxo-1H-quinazolin-2-yl)methyl]amino]methyl]benzonitrile Traditional Name: 4-fluoro-3-[[(4-keto-1H-quinazolin-2-yl)methyl-methyl-amino]methyl]benzonitrile Formula: C18H15FN4O MolecularWeight: 322.336303

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=C(C=CC(=C1)C#N)F)CC2=NC(=O)C3=CC=CC=C3N2

Isomeric SMILES

CN(CC1=C(C=CC(=C1)C#N)F)CC2=NC(=O)C3=CC=CC=C3N2

InChI

InChI=1S/C18H15FN4O/c1-23(10-13-8-12(9-20)6-7-15(13)19)11-17-21-16-5-3-2-4-14(16)18(24)22-17/h2-8H,10-11H2,1H3,(H,21,22,24)