6-[(4-bromophenyl)methyl]-3-ethyl-1-(5-phenylpentan-2-yl)-2H-pyrazolo[3,4-d]pyrimidin-4-one

Systemtic Name: 6-[(4-bromophenyl)methyl]-3-ethyl-1-(5-phenylpentan-2-yl)-2H-pyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 6-[(4-bromophenyl)methyl]-3-ethyl-1-(1-methyl-4-phenyl-butyl)-2H-pyrazolo[3,4-d]pyrimidin-4-one CAS Name: 6-[(4-bromophenyl)methyl]-3-ethyl-1-(5-phenylpentan-2-yl)-2H-pyrazolo[3,4-d]pyrimidin-4-one IUPAC Name: 6-[(4-bromophenyl)methyl]-3-ethyl-1-(5-phenylpentan-2-yl)-2H-pyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 6-(4-bromobenzyl)-3-ethyl-1-(1-methyl-4-phenyl-butyl)-2H-pyrazolo[3,4-d]pyrimidin-4-one Formula: C25H27BrN4O MolecularWeight: 479.41208

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C2C(=NC(=NC2=O)CC3=CC=C(C=C3)Br)N(N1)C(C)CCCC4=CC=CC=C4

Isomeric SMILES

CCC1=C2C(=NC(=NC2=O)CC3=CC=C(C=C3)Br)N(N1)C(C)CCCC4=CC=CC=C4

InChI

InChI=1S/C25H27BrN4O/c1-3-21-23-24(27-22(28-25(23)31)16-19-12-14-20(26)15-13-19)30(29-21)17(2)8-7-11-18-9-5-4-6-10-18/h4-6,9-10,12-15,17,29H,3,7-8,11,16H2,1-2H3