4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanyl-3-oxidanylidene-2-(4-phenyl-1,3-thiazol-2-yl)butanenitrile

Systemtic Name: 4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanyl-3-oxidanylidene-2-(4-phenyl-1,3-thiazol-2-yl)butanenitrile Openeye Name: 4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanyl-3-oxo-2-(4-phenylthiazol-2-yl)butanenitrile CAS Name: 4-[(1-methyl-4-pyrazolo[3,4-d]pyrimidinyl)thio]-3-oxo-2-(4-phenyl-2-thiazolyl)butanenitrile IUPAC Name: 4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanyl-3-oxo-2-(4-phenyl-1,3-thiazol-2-yl)butanenitrile Traditional Name: 3-keto-4-[(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)thio]-2-(4-phenylthiazol-2-yl)butyronitrile Formula: C19H14N6OS2 MolecularWeight: 406.48406

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=N1)C(=NC=N2)SCC(=O)C(C#N)C3=NC(=CS3)C4=CC=CC=C4

Isomeric SMILES

CN1C2=C(C=N1)C(=NC=N2)SCC(=O)C(C#N)C3=NC(=CS3)C4=CC=CC=C4

InChI

InChI=1S/C19H14N6OS2/c1-25-17-14(8-23-25)18(22-11-21-17)28-10-16(26)13(7-20)19-24-15(9-27-19)12-5-3-2-4-6-12/h2-6,8-9,11,13H,10H2,1H3