2-(4-methyl-1,3-thiazol-2-yl)-3-oxidanylidene-4-(4-oxidanylidene-3-prop-2-enyl-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-butanenitrile

Systemtic Name: 2-(4-methyl-1,3-thiazol-2-yl)-3-oxidanylidene-4-(4-oxidanylidene-3-prop-2-enyl-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-butanenitrile Openeye Name: 4-(3-allyl-4-oxo-thieno[2,3-d]pyrimidin-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-thieno[2,3-d]pyrimidinyl)thio]butanenitrile IUPAC Name: 2-(4-methyl-1,3-thiazol-2-yl)-3-oxo-4-(4-oxo-3-prop-2-enylthieno[2,3-d]pyrimidin-2-yl)sulfanylbutanenitrile Traditional Name: 4-[(3-allyl-4-keto-thieno[2,3-d]pyrimidin-2-yl)thio]-3-keto-2-(4-methylthiazol-2-yl)butyronitrile Formula: C17H14N4O2S3 MolecularWeight: 402.51366

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=N1)C(C#N)C(=O)CSC2=NC3=C(C=CS3)C(=O)N2CC=C

Isomeric SMILES

CC1=CSC(=N1)C(C#N)C(=O)CSC2=NC3=C(C=CS3)C(=O)N2CC=C

InChI

InChI=1S/C17H14N4O2S3/c1-3-5-21-16(23)11-4-6-24-14(11)20-17(21)26-9-13(22)12(7-18)15-19-10(2)8-25-15/h3-4,6,8,12H,1,5,9H2,2H3