3-[[(7-chloranyl-4-oxidanylidene-1H-quinazolin-2-yl)methyl-ethyl-amino]methyl]-4-fluoranyl-benzenecarbonitrile

Systemtic Name: 3-[[(7-chloranyl-4-oxidanylidene-1H-quinazolin-2-yl)methyl-ethyl-amino]methyl]-4-fluoranyl-benzenecarbonitrile Openeye Name: 3-[[(7-chloro-4-oxo-1H-quinazolin-2-yl)methyl-ethyl-amino]methyl]-4-fluoro-benzonitrile CAS Name: 3-[[(7-chloro-4-oxo-1H-quinazolin-2-yl)methyl-ethylamino]methyl]-4-fluorobenzonitrile IUPAC Name: 3-[[(7-chloro-4-oxo-1H-quinazolin-2-yl)methyl-ethylamino]methyl]-4-fluorobenzonitrile Traditional Name: 3-[[(7-chloro-4-keto-1H-quinazolin-2-yl)methyl-ethyl-amino]methyl]-4-fluoro-benzonitrile Formula: C19H16ClFN4O MolecularWeight: 370.807943

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=C(C=CC(=C1)C#N)F)CC2=NC(=O)C3=C(N2)C=C(C=C3)Cl

Isomeric SMILES

CCN(CC1=C(C=CC(=C1)C#N)F)CC2=NC(=O)C3=C(N2)C=C(C=C3)Cl

InChI

InChI=1S/C19H16ClFN4O/c1-2-25(10-13-7-12(9-22)3-6-16(13)21)11-18-23-17-8-14(20)4-5-15(17)19(26)24-18/h3-8H,2,10-11H2,1H3,(H,23,24,26)