6-[(3,5-dimethoxyphenyl)methyl]-3-(4-phenylsulfanylphenyl)-1H-pyrazolo[1,5-a]pyrimidin-7-one

Systemtic Name: 6-[(3,5-dimethoxyphenyl)methyl]-3-(4-phenylsulfanylphenyl)-1H-pyrazolo[1,5-a]pyrimidin-7-one Openeye Name: 6-[(3,5-dimethoxyphenyl)methyl]-3-(4-phenylsulfanylphenyl)-1H-pyrazolo[1,5-a]pyrimidin-7-one CAS Name: 6-[(3,5-dimethoxyphenyl)methyl]-3-[4-(phenylthio)phenyl]-1H-pyrazolo[1,5-a]pyrimidin-7-one IUPAC Name: 6-[(3,5-dimethoxyphenyl)methyl]-3-(4-phenylsulfanylphenyl)-1H-pyrazolo[1,5-a]pyrimidin-7-one Traditional Name: 6-(3,5-dimethoxybenzyl)-3-[4-(phenylthio)phenyl]-1H-pyrazolo[1,5-a]pyrimidin-7-one Formula: C27H23N3O3S MolecularWeight: 469.55482

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)CC2=CN=C3C(=CNN3C2=O)C4=CC=C(C=C4)SC5=CC=CC=C5)OC

Isomeric SMILES

COC1=CC(=CC(=C1)CC2=CN=C3C(=CNN3C2=O)C4=CC=C(C=C4)SC5=CC=CC=C5)OC

InChI

InChI=1S/C27H23N3O3S/c1-32-21-13-18(14-22(15-21)33-2)12-20-16-28-26-25(17-29-30(26)27(20)31)19-8-10-24(11-9-19)34-23-6-4-3-5-7-23/h3-11,13-17,29H,12H2,1-2H3