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

Systemtic Name: 2-[4-azanyl-5-(4-ethoxyphenyl)-3-methyl-pyrazolo[3,4-d]pyrimidin-6-yl]sulfanyl-N-butan-2-yl-ethanamide Openeye Name: 2-[4-amino-5-(4-ethoxyphenyl)-3-methyl-pyrazolo[3,4-d]pyrimidin-6-yl]sulfanyl-N-sec-butyl-acetamide CAS Name: 2-[[4-amino-5-(4-ethoxyphenyl)-3-methyl-6-pyrazolo[3,4-d]pyrimidinyl]thio]-N-butan-2-ylacetamide IUPAC Name: 2-[4-amino-5-(4-ethoxyphenyl)-3-methylpyrazolo[3,4-d]pyrimidin-6-yl]sulfanyl-N-butan-2-ylacetamide Traditional Name: 2-[(4-amino-3-methyl-5-p-phenetyl-pyrazolo[3,4-d]pyrimidin-6-yl)thio]-N-sec-butyl-acetamide Formula: C20H26N6O2S MolecularWeight: 414.52444

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H26N6O2S/c1-5-12(3)22-16(27)11-29-20-23-19-17(13(4)24-25-19)18(21)26(20)14-7-9-15(10-8-14)28-6-2/h7-10,12H,5-6,11,21H2,1-4H3,(H,22,27)