2-(4-methylsulfanyl-1-phenyl-pyrazolo[3,4-d]pyrimidin-6-yl)sulfanylbutanamide

Systemtic Name: 2-(4-methylsulfanyl-1-phenyl-pyrazolo[3,4-d]pyrimidin-6-yl)sulfanylbutanamide Openeye Name: 2-(4-methylsulfanyl-1-phenyl-pyrazolo[3,4-d]pyrimidin-6-yl)sulfanylbutanamide CAS Name: 2-[[4-(methylthio)-1-phenyl-6-pyrazolo[3,4-d]pyrimidinyl]thio]butanamide IUPAC Name: 2-(4-methylsulfanyl-1-phenylpyrazolo[3,4-d]pyrimidin-6-yl)sulfanylbutanamide Traditional Name: 2-[[4-(methylthio)-1-phenyl-pyrazolo[3,4-d]pyrimidin-6-yl]thio]butyramide Formula: C16H17N5OS2 MolecularWeight: 359.46908

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)N)SC1=NC2=C(C=NN2C3=CC=CC=C3)C(=N1)SC

Isomeric SMILES

CCC(C(=O)N)SC1=NC2=C(C=NN2C3=CC=CC=C3)C(=N1)SC

InChI

InChI=1S/C16H17N5OS2/c1-3-12(13(17)22)24-16-19-14-11(15(20-16)23-2)9-18-21(14)10-7-5-4-6-8-10/h4-9,12H,3H2,1-2H3,(H2,17,22)