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

Systemtic Name: 2-[4-azanyl-3-methyl-5-(3-methylphenyl)pyrazolo[3,4-d]pyrimidin-6-yl]sulfanyl-N-(4-ethylphenyl)ethanamide Openeye Name: 2-[4-amino-3-methyl-5-(m-tolyl)pyrazolo[3,4-d]pyrimidin-6-yl]sulfanyl-N-(4-ethylphenyl)acetamide CAS Name: 2-[[4-amino-3-methyl-5-(3-methylphenyl)-6-pyrazolo[3,4-d]pyrimidinyl]thio]-N-(4-ethylphenyl)acetamide IUPAC Name: 2-[4-amino-3-methyl-5-(3-methylphenyl)pyrazolo[3,4-d]pyrimidin-6-yl]sulfanyl-N-(4-ethylphenyl)acetamide Traditional Name: 2-[[4-amino-3-methyl-5-(m-tolyl)pyrazolo[3,4-d]pyrimidin-6-yl]thio]-N-(4-ethylphenyl)acetamide Formula: C23H24N6OS MolecularWeight: 432.54126

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC(=O)CSC2=NC3=NN=C(C3=C(N2C4=CC=CC(=C4)C)N)C

Isomeric SMILES

CCC1=CC=C(C=C1)NC(=O)CSC2=NC3=NN=C(C3=C(N2C4=CC=CC(=C4)C)N)C

InChI

InChI=1S/C23H24N6OS/c1-4-16-8-10-17(11-9-16)25-19(30)13-31-23-26-22-20(15(3)27-28-22)21(24)29(23)18-7-5-6-14(2)12-18/h5-12H,4,13,24H2,1-3H3,(H,25,30)