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

Systemtic Name: 2-(1-methyl-4-oxidanylidene-pyrazolo[3,4-d]pyrimidin-5-yl)-N-(5-pentyl-1,3,4-thiadiazol-2-yl)ethanamide Openeye Name: 2-(1-methyl-4-oxo-pyrazolo[3,4-d]pyrimidin-5-yl)-N-(5-pentyl-1,3,4-thiadiazol-2-yl)acetamide CAS Name: 2-(1-methyl-4-oxo-5-pyrazolo[3,4-d]pyrimidinyl)-N-(5-pentyl-1,3,4-thiadiazol-2-yl)acetamide IUPAC Name: 2-(1-methyl-4-oxopyrazolo[3,4-d]pyrimidin-5-yl)-N-(5-pentyl-1,3,4-thiadiazol-2-yl)acetamide Traditional Name: N-(5-amyl-1,3,4-thiadiazol-2-yl)-2-(4-keto-1-methyl-pyrazolo[3,4-d]pyrimidin-5-yl)acetamide Formula: C15H19N7O2S MolecularWeight: 361.42206

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=NN=C(S1)NC(=O)CN2C=NC3=C(C2=O)C=NN3C

Isomeric SMILES

CCCCCC1=NN=C(S1)NC(=O)CN2C=NC3=C(C2=O)C=NN3C

InChI

InChI=1S/C15H19N7O2S/c1-3-4-5-6-12-19-20-15(25-12)18-11(23)8-22-9-16-13-10(14(22)24)7-17-21(13)2/h7,9H,3-6,8H2,1-2H3,(H,18,20,23)