3-[(3-cyclopropyl-4-oxidanylidene-quinazolin-2-yl)sulfanylmethyl]-4-fluoranyl-benzenecarbonitrile

Systemtic Name: 3-[(3-cyclopropyl-4-oxidanylidene-quinazolin-2-yl)sulfanylmethyl]-4-fluoranyl-benzenecarbonitrile Openeye Name: 3-[(3-cyclopropyl-4-oxo-quinazolin-2-yl)sulfanylmethyl]-4-fluoro-benzonitrile CAS Name: 3-[[(3-cyclopropyl-4-oxo-2-quinazolinyl)thio]methyl]-4-fluorobenzonitrile IUPAC Name: 3-[(3-cyclopropyl-4-oxoquinazolin-2-yl)sulfanylmethyl]-4-fluorobenzonitrile Traditional Name: 3-[[(3-cyclopropyl-4-keto-quinazolin-2-yl)thio]methyl]-4-fluoro-benzonitrile Formula: C19H14FN3OS MolecularWeight: 351.397363

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C(=O)C3=CC=CC=C3N=C2SCC4=C(C=CC(=C4)C#N)F

Isomeric SMILES

C1CC1N2C(=O)C3=CC=CC=C3N=C2SCC4=C(C=CC(=C4)C#N)F

InChI

InChI=1S/C19H14FN3OS/c20-16-8-5-12(10-21)9-13(16)11-25-19-22-17-4-2-1-3-15(17)18(24)23(19)14-6-7-14/h1-5,8-9,14H,6-7,11H2