1-[2-(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanylethanoyl]piperidine-4-carboxamide

Systemtic Name: 1-[2-(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanylethanoyl]piperidine-4-carboxamide Openeye Name: 1-[2-(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanylacetyl]piperidine-4-carboxamide CAS Name: 1-[1-oxo-2-[(1-phenyl-4-pyrazolo[3,4-d]pyrimidinyl)thio]ethyl]-4-piperidinecarboxamide IUPAC Name: 1-[2-(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanylacetyl]piperidine-4-carboxamide Traditional Name: 1-[2-[(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)thio]acetyl]isonipecotamide Formula: C19H20N6O2S MolecularWeight: 396.4661

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)N)C(=O)CSC2=NC=NC3=C2C=NN3C4=CC=CC=C4

Isomeric SMILES

C1CN(CCC1C(=O)N)C(=O)CSC2=NC=NC3=C2C=NN3C4=CC=CC=C4

InChI

InChI=1S/C19H20N6O2S/c20-17(27)13-6-8-24(9-7-13)16(26)11-28-19-15-10-23-25(18(15)21-12-22-19)14-4-2-1-3-5-14/h1-5,10,12-13H,6-9,11H2,(H2,20,27)