N-(3-indol-1-ylpropyl)-2-(1-methyl-4-oxidanylidene-pyrazolo[3,4-d]pyrimidin-5-yl)ethanamide

Systemtic Name: N-(3-indol-1-ylpropyl)-2-(1-methyl-4-oxidanylidene-pyrazolo[3,4-d]pyrimidin-5-yl)ethanamide Openeye Name: N-(3-indol-1-ylpropyl)-2-(1-methyl-4-oxo-pyrazolo[3,4-d]pyrimidin-5-yl)acetamide CAS Name: N-[3-(1-indolyl)propyl]-2-(1-methyl-4-oxo-5-pyrazolo[3,4-d]pyrimidinyl)acetamide IUPAC Name: N-(3-indol-1-ylpropyl)-2-(1-methyl-4-oxopyrazolo[3,4-d]pyrimidin-5-yl)acetamide Traditional Name: N-(3-indol-1-ylpropyl)-2-(4-keto-1-methyl-pyrazolo[3,4-d]pyrimidin-5-yl)acetamide Formula: C19H20N6O2 MolecularWeight: 364.4011

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=N1)C(=O)N(C=N2)CC(=O)NCCCN3C=CC4=CC=CC=C43

Isomeric SMILES

CN1C2=C(C=N1)C(=O)N(C=N2)CC(=O)NCCCN3C=CC4=CC=CC=C43

InChI

InChI=1S/C19H20N6O2/c1-23-18-15(11-22-23)19(27)25(13-21-18)12-17(26)20-8-4-9-24-10-7-14-5-2-3-6-16(14)24/h2-3,5-7,10-11,13H,4,8-9,12H2,1H3,(H,20,26)