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

Systemtic Name: 2-methyl-5-[(4-methylphenyl)sulfanylmethyl]-3-phenyl-1H-pyrazolo[1,5-a]pyrimidin-7-one Openeye Name: 2-methyl-3-phenyl-5-(p-tolylsulfanylmethyl)-1H-pyrazolo[1,5-a]pyrimidin-7-one CAS Name: 2-methyl-5-[[(4-methylphenyl)thio]methyl]-3-phenyl-1H-pyrazolo[1,5-a]pyrimidin-7-one IUPAC Name: 2-methyl-5-[(4-methylphenyl)sulfanylmethyl]-3-phenyl-1H-pyrazolo[1,5-a]pyrimidin-7-one Traditional Name: 2-methyl-3-phenyl-5-[(p-tolylthio)methyl]-1H-pyrazolo[1,5-a]pyrimidin-7-one Formula: C21H19N3OS MolecularWeight: 361.46006

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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=CC=C4

Isomeric SMILES

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

InChI

InChI=1S/C21H19N3OS/c1-14-8-10-18(11-9-14)26-13-17-12-19(25)24-21(22-17)20(15(2)23-24)16-6-4-3-5-7-16/h3-12,23H,13H2,1-2H3