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

Systemtic Name: 2-(4-methyl-1,3-thiazol-2-yl)-3-oxidanylidene-4-(4-oxidanylidene-3-prop-2-enyl-quinazolin-2-yl)sulfanyl-butanenitrile Openeye Name: 4-(3-allyl-4-oxo-quinazolin-2-yl)sulfanyl-2-(4-methylthiazol-2-yl)-3-oxo-butanenitrile CAS Name: 2-(4-methyl-2-thiazolyl)-3-oxo-4-[(4-oxo-3-prop-2-enyl-2-quinazolinyl)thio]butanenitrile IUPAC Name: 2-(4-methyl-1,3-thiazol-2-yl)-3-oxo-4-(4-oxo-3-prop-2-enylquinazolin-2-yl)sulfanylbutanenitrile Traditional Name: 4-[(3-allyl-4-keto-quinazolin-2-yl)thio]-3-keto-2-(4-methylthiazol-2-yl)butyronitrile Formula: C19H16N4O2S2 MolecularWeight: 396.48594

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=N1)C(C#N)C(=O)CSC2=NC3=CC=CC=C3C(=O)N2CC=C

Isomeric SMILES

CC1=CSC(=N1)C(C#N)C(=O)CSC2=NC3=CC=CC=C3C(=O)N2CC=C

InChI

InChI=1S/C19H16N4O2S2/c1-3-8-23-18(25)13-6-4-5-7-15(13)22-19(23)27-11-16(24)14(9-20)17-21-12(2)10-26-17/h3-7,10,14H,1,8,11H2,2H3