N-[2-(diethylamino)-3-phenyl-propyl]-2-(1-methyl-4-oxidanylidene-pyrazolo[3,4-d]pyrimidin-5-yl)ethanamide

Systemtic Name: N-[2-(diethylamino)-3-phenyl-propyl]-2-(1-methyl-4-oxidanylidene-pyrazolo[3,4-d]pyrimidin-5-yl)ethanamide Openeye Name: N-[2-(diethylamino)-3-phenyl-propyl]-2-(1-methyl-4-oxo-pyrazolo[3,4-d]pyrimidin-5-yl)acetamide CAS Name: N-[2-(diethylamino)-3-phenylpropyl]-2-(1-methyl-4-oxo-5-pyrazolo[3,4-d]pyrimidinyl)acetamide IUPAC Name: N-[2-(diethylamino)-3-phenylpropyl]-2-(1-methyl-4-oxopyrazolo[3,4-d]pyrimidin-5-yl)acetamide Traditional Name: N-[2-(diethylamino)-3-phenyl-propyl]-2-(4-keto-1-methyl-pyrazolo[3,4-d]pyrimidin-5-yl)acetamide Formula: C21H28N6O2 MolecularWeight: 396.48602

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(CC1=CC=CC=C1)CNC(=O)CN2C=NC3=C(C2=O)C=NN3C

Isomeric SMILES

CCN(CC)C(CC1=CC=CC=C1)CNC(=O)CN2C=NC3=C(C2=O)C=NN3C

InChI

InChI=1S/C21H28N6O2/c1-4-26(5-2)17(11-16-9-7-6-8-10-16)12-22-19(28)14-27-15-23-20-18(21(27)29)13-24-25(20)3/h6-10,13,15,17H,4-5,11-12,14H2,1-3H3,(H,22,28)