2-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanyl-N-(4-piperidin-1-ylphenyl)ethanamide

Systemtic Name: 2-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanyl-N-(4-piperidin-1-ylphenyl)ethanamide Openeye Name: 2-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanyl-N-[4-(1-piperidyl)phenyl]acetamide CAS Name: 2-[(1-methyl-4-pyrazolo[3,4-d]pyrimidinyl)thio]-N-[4-(1-piperidinyl)phenyl]acetamide IUPAC Name: 2-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanyl-N-(4-piperidin-1-ylphenyl)acetamide Traditional Name: 2-[(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)thio]-N-(4-piperidinophenyl)acetamide Formula: C19H22N6OS MolecularWeight: 382.48258

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=N1)C(=NC=N2)SCC(=O)NC3=CC=C(C=C3)N4CCCCC4

Isomeric SMILES

CN1C2=C(C=N1)C(=NC=N2)SCC(=O)NC3=CC=C(C=C3)N4CCCCC4

InChI

InChI=1S/C19H22N6OS/c1-24-18-16(11-22-24)19(21-13-20-18)27-12-17(26)23-14-5-7-15(8-6-14)25-9-3-2-4-10-25/h5-8,11,13H,2-4,9-10,12H2,1H3,(H,23,26)