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

Systemtic Name: 2-(4-methyl-1,3-thiazol-2-yl)-3-oxidanylidene-4-(4-oxidanylidene-3-phenyl-quinazolin-2-yl)sulfanyl-butanenitrile Openeye Name: 2-(4-methylthiazol-2-yl)-3-oxo-4-(4-oxo-3-phenyl-quinazolin-2-yl)sulfanyl-butanenitrile CAS Name: 2-(4-methyl-2-thiazolyl)-3-oxo-4-[(4-oxo-3-phenyl-2-quinazolinyl)thio]butanenitrile IUPAC Name: 2-(4-methyl-1,3-thiazol-2-yl)-3-oxo-4-(4-oxo-3-phenylquinazolin-2-yl)sulfanylbutanenitrile Traditional Name: 3-keto-4-[(4-keto-3-phenyl-quinazolin-2-yl)thio]-2-(4-methylthiazol-2-yl)butyronitrile Formula: C22H16N4O2S2 MolecularWeight: 432.51804

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=N1)C(C#N)C(=O)CSC2=NC3=CC=CC=C3C(=O)N2C4=CC=CC=C4

Isomeric SMILES

CC1=CSC(=N1)C(C#N)C(=O)CSC2=NC3=CC=CC=C3C(=O)N2C4=CC=CC=C4

InChI

InChI=1S/C22H16N4O2S2/c1-14-12-29-20(24-14)17(11-23)19(27)13-30-22-25-18-10-6-5-9-16(18)21(28)26(22)15-7-3-2-4-8-15/h2-10,12,17H,13H2,1H3