2-methyl-3-phenyl-5-(pyridin-2-ylsulfanylmethyl)-1H-pyrazolo[1,5-a]pyrimidin-7-one

Systemtic Name: 2-methyl-3-phenyl-5-(pyridin-2-ylsulfanylmethyl)-1H-pyrazolo[1,5-a]pyrimidin-7-one Openeye Name: 2-methyl-3-phenyl-5-(2-pyridylsulfanylmethyl)-1H-pyrazolo[1,5-a]pyrimidin-7-one CAS Name: 2-methyl-3-phenyl-5-[(2-pyridinylthio)methyl]-1H-pyrazolo[1,5-a]pyrimidin-7-one IUPAC Name: 2-methyl-3-phenyl-5-(pyridin-2-ylsulfanylmethyl)-1H-pyrazolo[1,5-a]pyrimidin-7-one Traditional Name: 2-methyl-3-phenyl-5-[(2-pyridylthio)methyl]-1H-pyrazolo[1,5-a]pyrimidin-7-one Formula: C19H16N4OS MolecularWeight: 348.42154

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=NC(=CC(=O)N2N1)CSC3=CC=CC=N3)C4=CC=CC=C4

Isomeric SMILES

CC1=C(C2=NC(=CC(=O)N2N1)CSC3=CC=CC=N3)C4=CC=CC=C4

InChI

InChI=1S/C19H16N4OS/c1-13-18(14-7-3-2-4-8-14)19-21-15(11-17(24)23(19)22-13)12-25-16-9-5-6-10-20-16/h2-11,22H,12H2,1H3