3-ethyl-6-[(4-morpholin-4-ylsulfonylphenyl)methyl]-1-(2-oxidanyl-6-phenyl-hexan-3-yl)-2H-pyrazolo[3,4-d]pyrimidin-4-one

Systemtic Name: 3-ethyl-6-[(4-morpholin-4-ylsulfonylphenyl)methyl]-1-(2-oxidanyl-6-phenyl-hexan-3-yl)-2H-pyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 3-ethyl-1-[1-(1-hydroxyethyl)-4-phenyl-butyl]-6-[(4-morpholinosulfonylphenyl)methyl]-2H-pyrazolo[3,4-d]pyrimidin-4-one CAS Name: 3-ethyl-1-(2-hydroxy-6-phenylhexan-3-yl)-6-[[4-(4-morpholinylsulfonyl)phenyl]methyl]-2H-pyrazolo[3,4-d]pyrimidin-4-one IUPAC Name: 3-ethyl-1-(2-hydroxy-6-phenylhexan-3-yl)-6-[(4-morpholin-4-ylsulfonylphenyl)methyl]-2H-pyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 3-ethyl-1-[1-(1-hydroxyethyl)-4-phenyl-butyl]-6-(4-morpholinosulfonylbenzyl)-2H-pyrazolo[3,4-d]pyrimidin-4-one Formula: C30H37N5O5S MolecularWeight: 579.71028

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C2C(=NC(=NC2=O)CC3=CC=C(C=C3)S(=O)(=O)N4CCOCC4)N(N1)C(CCCC5=CC=CC=C5)C(C)O

Isomeric SMILES

CCC1=C2C(=NC(=NC2=O)CC3=CC=C(C=C3)S(=O)(=O)N4CCOCC4)N(N1)C(CCCC5=CC=CC=C5)C(C)O

InChI

InChI=1S/C30H37N5O5S/c1-3-25-28-29(35(33-25)26(21(2)36)11-7-10-22-8-5-4-6-9-22)31-27(32-30(28)37)20-23-12-14-24(15-13-23)41(38,39)34-16-18-40-19-17-34/h4-6,8-9,12-15,21,26,33,36H,3,7,10-11,16-20H2,1-2H3