4-[2-[(5-tert-butyl-1,2,4-oxadiazol-3-yl)methylsulfanyl]-4-oxidanylidene-quinazolin-3-yl]benzenecarbonitrile

Systemtic Name: 4-[2-[(5-tert-butyl-1,2,4-oxadiazol-3-yl)methylsulfanyl]-4-oxidanylidene-quinazolin-3-yl]benzenecarbonitrile Openeye Name: 4-[2-[(5-tert-butyl-1,2,4-oxadiazol-3-yl)methylsulfanyl]-4-oxo-quinazolin-3-yl]benzonitrile CAS Name: 4-[2-[(5-tert-butyl-1,2,4-oxadiazol-3-yl)methylthio]-4-oxo-3-quinazolinyl]benzonitrile IUPAC Name: 4-[2-[(5-tert-butyl-1,2,4-oxadiazol-3-yl)methylsulfanyl]-4-oxoquinazolin-3-yl]benzonitrile Traditional Name: 4-[2-[(5-tert-butyl-1,2,4-oxadiazol-3-yl)methylthio]-4-keto-quinazolin-3-yl]benzonitrile Formula: C22H19N5O2S MolecularWeight: 417.48356

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NC(=NO1)CSC2=NC3=CC=CC=C3C(=O)N2C4=CC=C(C=C4)C#N

Isomeric SMILES

CC(C)(C)C1=NC(=NO1)CSC2=NC3=CC=CC=C3C(=O)N2C4=CC=C(C=C4)C#N

InChI

InChI=1S/C22H19N5O2S/c1-22(2,3)20-25-18(26-29-20)13-30-21-24-17-7-5-4-6-16(17)19(28)27(21)15-10-8-14(12-23)9-11-15/h4-11H,13H2,1-3H3