4-(3-butyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-2-(4-methyl-1,3-thiazol-2-yl)-3-oxidanylidene-butanenitrile

Systemtic Name: 4-(3-butyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-2-(4-methyl-1,3-thiazol-2-yl)-3-oxidanylidene-butanenitrile Openeye Name: 4-(3-butyl-4-oxo-quinazolin-2-yl)sulfanyl-2-(4-methylthiazol-2-yl)-3-oxo-butanenitrile CAS Name: 4-[(3-butyl-4-oxo-2-quinazolinyl)thio]-2-(4-methyl-2-thiazolyl)-3-oxobutanenitrile IUPAC Name: 4-(3-butyl-4-oxoquinazolin-2-yl)sulfanyl-2-(4-methyl-1,3-thiazol-2-yl)-3-oxobutanenitrile Traditional Name: 4-[(3-butyl-4-keto-quinazolin-2-yl)thio]-3-keto-2-(4-methylthiazol-2-yl)butyronitrile Formula: C20H20N4O2S2 MolecularWeight: 412.5284

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)C(C#N)C3=NC(=CS3)C

Isomeric SMILES

CCCCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)C(C#N)C3=NC(=CS3)C

InChI

InChI=1S/C20H20N4O2S2/c1-3-4-9-24-19(26)14-7-5-6-8-16(14)23-20(24)28-12-17(25)15(10-21)18-22-13(2)11-27-18/h5-8,11,15H,3-4,9,12H2,1-2H3