5-(chloromethyl)-2-methylsulfanyl-3-(phenylsulfonyl)-1H-pyrazolo[1,5-a]pyrimidin-7-one

Systemtic Name: 5-(chloromethyl)-2-methylsulfanyl-3-(phenylsulfonyl)-1H-pyrazolo[1,5-a]pyrimidin-7-one Openeye Name: 3-(benzenesulfonyl)-5-(chloromethyl)-2-methylsulfanyl-1H-pyrazolo[1,5-a]pyrimidin-7-one CAS Name: 3-(benzenesulfonyl)-5-(chloromethyl)-2-(methylthio)-1H-pyrazolo[1,5-a]pyrimidin-7-one IUPAC Name: 3-(benzenesulfonyl)-5-(chloromethyl)-2-methylsulfanyl-1H-pyrazolo[1,5-a]pyrimidin-7-one Traditional Name: 3-besyl-5-(chloromethyl)-2-(methylthio)-1H-pyrazolo[1,5-a]pyrimidin-7-one Formula: C14H12ClN3O3S2 MolecularWeight: 369.84638

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C2=NC(=CC(=O)N2N1)CCl)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CSC1=C(C2=NC(=CC(=O)N2N1)CCl)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C14H12ClN3O3S2/c1-22-14-12(23(20,21)10-5-3-2-4-6-10)13-16-9(8-15)7-11(19)18(13)17-14/h2-7,17H,8H2,1H3