N-[4-[4-(3-methyl-1-phenyl-6-propyl-pyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-yl]sulfonylphenyl]ethanamide

Systemtic Name: N-[4-[4-(3-methyl-1-phenyl-6-propyl-pyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-yl]sulfonylphenyl]ethanamide Openeye Name: N-[4-[4-(3-methyl-1-phenyl-6-propyl-pyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-yl]sulfonylphenyl]acetamide CAS Name: N-[4-[[4-(3-methyl-1-phenyl-6-propyl-4-pyrazolo[3,4-d]pyrimidinyl)-1-piperazinyl]sulfonyl]phenyl]acetamide IUPAC Name: N-[4-[4-(3-methyl-1-phenyl-6-propylpyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-yl]sulfonylphenyl]acetamide Traditional Name: N-[4-[4-(3-methyl-1-phenyl-6-propyl-pyrazolo[3,4-d]pyrimidin-4-yl)piperazino]sulfonylphenyl]acetamide Formula: C27H31N7O3S MolecularWeight: 533.64514

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC2=C(C(=NN2C3=CC=CC=C3)C)C(=N1)N4CCN(CC4)S(=O)(=O)C5=CC=C(C=C5)NC(=O)C

Isomeric SMILES

CCCC1=NC2=C(C(=NN2C3=CC=CC=C3)C)C(=N1)N4CCN(CC4)S(=O)(=O)C5=CC=C(C=C5)NC(=O)C

InChI

InChI=1S/C27H31N7O3S/c1-4-8-24-29-26(25-19(2)31-34(27(25)30-24)22-9-6-5-7-10-22)32-15-17-33(18-16-32)38(36,37)23-13-11-21(12-14-23)28-20(3)35/h5-7,9-14H,4,8,15-18H2,1-3H3,(H,28,35)