tert-butyl N-methyl-N-[3-[4-[1-(4-methylsulfonylphenyl)pyrazolo[3,4-d]pyrimidin-4-yl]oxypiperidin-1-yl]-3-oxidanylidene-propyl]carbamate

Systemtic Name: tert-butyl N-methyl-N-[3-[4-[1-(4-methylsulfonylphenyl)pyrazolo[3,4-d]pyrimidin-4-yl]oxypiperidin-1-yl]-3-oxidanylidene-propyl]carbamate Openeye Name: tert-butyl N-methyl-N-[3-[4-[1-(4-methylsulfonylphenyl)pyrazolo[3,4-d]pyrimidin-4-yl]oxy-1-piperidyl]-3-oxo-propyl]carbamate CAS Name: N-methyl-N-[3-[4-[[1-(4-methylsulfonylphenyl)-4-pyrazolo[3,4-d]pyrimidinyl]oxy]-1-piperidinyl]-3-oxopropyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-methyl-N-[3-[4-[1-(4-methylsulfonylphenyl)pyrazolo[3,4-d]pyrimidin-4-yl]oxypiperidin-1-yl]-3-oxopropyl]carbamate Traditional Name: N-[3-keto-3-[4-[1-(4-mesylphenyl)pyrazolo[3,4-d]pyrimidin-4-yl]oxypiperidino]propyl]-N-methyl-carbamic acid tert-butyl ester Formula: C26H34N6O6S MolecularWeight: 558.64976

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N(C)CCC(=O)N1CCC(CC1)OC2=NC=NC3=C2C=NN3C4=CC=C(C=C4)S(=O)(=O)C

Isomeric SMILES

CC(C)(C)OC(=O)N(C)CCC(=O)N1CCC(CC1)OC2=NC=NC3=C2C=NN3C4=CC=C(C=C4)S(=O)(=O)C

InChI

InChI=1S/C26H34N6O6S/c1-26(2,3)38-25(34)30(4)13-12-22(33)31-14-10-19(11-15-31)37-24-21-16-29-32(23(21)27-17-28-24)18-6-8-20(9-7-18)39(5,35)36/h6-9,16-17,19H,10-15H2,1-5H3