4-(2-butylsulfanyl-4-oxidanylidene-quinazolin-3-yl)benzenecarbonitrile

Systemtic Name: 4-(2-butylsulfanyl-4-oxidanylidene-quinazolin-3-yl)benzenecarbonitrile Openeye Name: 4-(2-butylsulfanyl-4-oxo-quinazolin-3-yl)benzonitrile CAS Name: 4-[2-(butylthio)-4-oxo-3-quinazolinyl]benzonitrile IUPAC Name: 4-(2-butylsulfanyl-4-oxoquinazolin-3-yl)benzonitrile Traditional Name: 4-[2-(butylthio)-4-keto-quinazolin-3-yl]benzonitrile Formula: C19H17N3OS MolecularWeight: 335.42278

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSC1=NC2=CC=CC=C2C(=O)N1C3=CC=C(C=C3)C#N

Isomeric SMILES

CCCCSC1=NC2=CC=CC=C2C(=O)N1C3=CC=C(C=C3)C#N

InChI

InChI=1S/C19H17N3OS/c1-2-3-12-24-19-21-17-7-5-4-6-16(17)18(23)22(19)15-10-8-14(13-20)9-11-15/h4-11H,2-3,12H2,1H3