4-[4-oxidanylidene-2-(2-propan-2-yloxyethylsulfanyl)quinazolin-3-yl]benzenecarbonitrile

Systemtic Name: 4-[4-oxidanylidene-2-(2-propan-2-yloxyethylsulfanyl)quinazolin-3-yl]benzenecarbonitrile Openeye Name: 4-[2-(2-isopropoxyethylsulfanyl)-4-oxo-quinazolin-3-yl]benzonitrile CAS Name: 4-[4-oxo-2-(2-propan-2-yloxyethylthio)-3-quinazolinyl]benzonitrile IUPAC Name: 4-[4-oxo-2-(2-propan-2-yloxyethylsulfanyl)quinazolin-3-yl]benzonitrile Traditional Name: 4-[2-(2-isopropoxyethylthio)-4-keto-quinazolin-3-yl]benzonitrile Formula: C20H19N3O2S MolecularWeight: 365.44876

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OCCSC1=NC2=CC=CC=C2C(=O)N1C3=CC=C(C=C3)C#N

Isomeric SMILES

CC(C)OCCSC1=NC2=CC=CC=C2C(=O)N1C3=CC=C(C=C3)C#N

InChI

InChI=1S/C20H19N3O2S/c1-14(2)25-11-12-26-20-22-18-6-4-3-5-17(18)19(24)23(20)16-9-7-15(13-21)8-10-16/h3-10,14H,11-12H2,1-2H3