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

Systemtic Name: 2-[4-azanyl-3-methyl-5-(2-methylphenyl)pyrazolo[3,4-d]pyrimidin-6-yl]sulfanyl-N-butan-2-yl-ethanamide Openeye Name: 2-[4-amino-3-methyl-5-(o-tolyl)pyrazolo[3,4-d]pyrimidin-6-yl]sulfanyl-N-sec-butyl-acetamide CAS Name: 2-[[4-amino-3-methyl-5-(2-methylphenyl)-6-pyrazolo[3,4-d]pyrimidinyl]thio]-N-butan-2-ylacetamide IUPAC Name: 2-[4-amino-3-methyl-5-(2-methylphenyl)pyrazolo[3,4-d]pyrimidin-6-yl]sulfanyl-N-butan-2-ylacetamide Traditional Name: 2-[[4-amino-3-methyl-5-(o-tolyl)pyrazolo[3,4-d]pyrimidin-6-yl]thio]-N-sec-butyl-acetamide Formula: C19H24N6OS MolecularWeight: 384.49846

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)CSC1=NC2=NN=C(C2=C(N1C3=CC=CC=C3C)N)C

Isomeric SMILES

CCC(C)NC(=O)CSC1=NC2=NN=C(C2=C(N1C3=CC=CC=C3C)N)C

InChI

InChI=1S/C19H24N6OS/c1-5-12(3)21-15(26)10-27-19-22-18-16(13(4)23-24-18)17(20)25(19)14-9-7-6-8-11(14)2/h6-9,12H,5,10,20H2,1-4H3,(H,21,26)