3-(4-methoxyphenyl)-2-methyl-5-[(4-methylphenyl)sulfanylmethyl]-1H-pyrazolo[1,5-a]pyrimidin-7-one

Systemtic Name: 3-(4-methoxyphenyl)-2-methyl-5-[(4-methylphenyl)sulfanylmethyl]-1H-pyrazolo[1,5-a]pyrimidin-7-one Openeye Name: 3-(4-methoxyphenyl)-2-methyl-5-(p-tolylsulfanylmethyl)-1H-pyrazolo[1,5-a]pyrimidin-7-one CAS Name: 3-(4-methoxyphenyl)-2-methyl-5-[[(4-methylphenyl)thio]methyl]-1H-pyrazolo[1,5-a]pyrimidin-7-one IUPAC Name: 3-(4-methoxyphenyl)-2-methyl-5-[(4-methylphenyl)sulfanylmethyl]-1H-pyrazolo[1,5-a]pyrimidin-7-one Traditional Name: 3-(4-methoxyphenyl)-2-methyl-5-[(p-tolylthio)methyl]-1H-pyrazolo[1,5-a]pyrimidin-7-one Formula: C22H21N3O2S MolecularWeight: 391.48604

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCC2=CC(=O)N3C(=N2)C(=C(N3)C)C4=CC=C(C=C4)OC

Isomeric SMILES

CC1=CC=C(C=C1)SCC2=CC(=O)N3C(=N2)C(=C(N3)C)C4=CC=C(C=C4)OC

InChI

InChI=1S/C22H21N3O2S/c1-14-4-10-19(11-5-14)28-13-17-12-20(26)25-22(23-17)21(15(2)24-25)16-6-8-18(27-3)9-7-16/h4-12,24H,13H2,1-3H3