4-[3-(5-methylpyridin-2-yl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-2-(4-methyl-1,3-thiazol-2-yl)-3-oxidanylidene-butanenitrile

Systemtic Name: 4-[3-(5-methylpyridin-2-yl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-2-(4-methyl-1,3-thiazol-2-yl)-3-oxidanylidene-butanenitrile Openeye Name: 4-[3-(5-methyl-2-pyridyl)-4-oxo-quinazolin-2-yl]sulfanyl-2-(4-methylthiazol-2-yl)-3-oxo-butanenitrile CAS Name: 4-[[3-(5-methyl-2-pyridinyl)-4-oxo-2-quinazolinyl]thio]-2-(4-methyl-2-thiazolyl)-3-oxobutanenitrile IUPAC Name: 4-[3-(5-methylpyridin-2-yl)-4-oxoquinazolin-2-yl]sulfanyl-2-(4-methyl-1,3-thiazol-2-yl)-3-oxobutanenitrile Traditional Name: 3-keto-4-[[4-keto-3-(5-methyl-2-pyridyl)quinazolin-2-yl]thio]-2-(4-methylthiazol-2-yl)butyronitrile Formula: C22H17N5O2S2 MolecularWeight: 447.53268

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)C(C#N)C4=NC(=CS4)C

Isomeric SMILES

CC1=CN=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)C(C#N)C4=NC(=CS4)C

InChI

InChI=1S/C22H17N5O2S2/c1-13-7-8-19(24-10-13)27-21(29)15-5-3-4-6-17(15)26-22(27)31-12-18(28)16(9-23)20-25-14(2)11-30-20/h3-8,10-11,16H,12H2,1-2H3