2-[4-azanyl-5-(3,4-dimethylphenyl)-3-methyl-pyrazolo[3,4-d]pyrimidin-6-yl]sulfanyl-N,N-dipropyl-ethanamide

Systemtic Name: 2-[4-azanyl-5-(3,4-dimethylphenyl)-3-methyl-pyrazolo[3,4-d]pyrimidin-6-yl]sulfanyl-N,N-dipropyl-ethanamide Openeye Name: 2-[4-amino-5-(3,4-dimethylphenyl)-3-methyl-pyrazolo[3,4-d]pyrimidin-6-yl]sulfanyl-N,N-dipropyl-acetamide CAS Name: 2-[[4-amino-5-(3,4-dimethylphenyl)-3-methyl-6-pyrazolo[3,4-d]pyrimidinyl]thio]-N,N-dipropylacetamide IUPAC Name: 2-[4-amino-5-(3,4-dimethylphenyl)-3-methylpyrazolo[3,4-d]pyrimidin-6-yl]sulfanyl-N,N-dipropylacetamide Traditional Name: 2-[[4-amino-5-(3,4-dimethylphenyl)-3-methyl-pyrazolo[3,4-d]pyrimidin-6-yl]thio]-N,N-dipropyl-acetamide Formula: C22H30N6OS MolecularWeight: 426.5782

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCC)C(=O)CSC1=NC2=NN=C(C2=C(N1C3=CC(=C(C=C3)C)C)N)C

Isomeric SMILES

CCCN(CCC)C(=O)CSC1=NC2=NN=C(C2=C(N1C3=CC(=C(C=C3)C)C)N)C

InChI

InChI=1S/C22H30N6OS/c1-6-10-27(11-7-2)18(29)13-30-22-24-21-19(16(5)25-26-21)20(23)28(22)17-9-8-14(3)15(4)12-17/h8-9,12H,6-7,10-11,13,23H2,1-5H3