N-[2-(6-ethylsulfanyl-4-pyrrolidin-1-yl-pyrazolo[3,4-d]pyrimidin-1-yl)ethyl]-2-(4-propan-2-ylsulfonylphenyl)ethanamide

Systemtic Name: N-[2-(6-ethylsulfanyl-4-pyrrolidin-1-yl-pyrazolo[3,4-d]pyrimidin-1-yl)ethyl]-2-(4-propan-2-ylsulfonylphenyl)ethanamide Openeye Name: N-[2-(6-ethylsulfanyl-4-pyrrolidin-1-yl-pyrazolo[3,4-d]pyrimidin-1-yl)ethyl]-2-(4-isopropylsulfonylphenyl)acetamide CAS Name: N-[2-[6-(ethylthio)-4-(1-pyrrolidinyl)-1-pyrazolo[3,4-d]pyrimidinyl]ethyl]-2-(4-propan-2-ylsulfonylphenyl)acetamide IUPAC Name: N-[2-(6-ethylsulfanyl-4-pyrrolidin-1-ylpyrazolo[3,4-d]pyrimidin-1-yl)ethyl]-2-(4-propan-2-ylsulfonylphenyl)acetamide Traditional Name: N-[2-[6-(ethylthio)-4-pyrrolidino-pyrazolo[3,4-d]pyrimidin-1-yl]ethyl]-2-(4-isopropylsulfonylphenyl)acetamide Formula: C24H32N6O3S2 MolecularWeight: 516.67928

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NC2=C(C=NN2CCNC(=O)CC3=CC=C(C=C3)S(=O)(=O)C(C)C)C(=N1)N4CCCC4

Isomeric SMILES

CCSC1=NC2=C(C=NN2CCNC(=O)CC3=CC=C(C=C3)S(=O)(=O)C(C)C)C(=N1)N4CCCC4

InChI

InChI=1S/C24H32N6O3S2/c1-4-34-24-27-22(29-12-5-6-13-29)20-16-26-30(23(20)28-24)14-11-25-21(31)15-18-7-9-19(10-8-18)35(32,33)17(2)3/h7-10,16-17H,4-6,11-15H2,1-3H3,(H,25,31)