5-(chloromethyl)-2-(4-phenylsulfanylphenyl)-1H-pyrazolo[1,5-a]pyrimidin-7-one

Systemtic Name: 5-(chloromethyl)-2-(4-phenylsulfanylphenyl)-1H-pyrazolo[1,5-a]pyrimidin-7-one Openeye Name: 5-(chloromethyl)-2-(4-phenylsulfanylphenyl)-1H-pyrazolo[1,5-a]pyrimidin-7-one CAS Name: 5-(chloromethyl)-2-[4-(phenylthio)phenyl]-1H-pyrazolo[1,5-a]pyrimidin-7-one IUPAC Name: 5-(chloromethyl)-2-(4-phenylsulfanylphenyl)-1H-pyrazolo[1,5-a]pyrimidin-7-one Traditional Name: 5-(chloromethyl)-2-[4-(phenylthio)phenyl]-1H-pyrazolo[1,5-a]pyrimidin-7-one Formula: C19H14ClN3OS MolecularWeight: 367.85196

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SC2=CC=C(C=C2)C3=CC4=NC(=CC(=O)N4N3)CCl

Isomeric SMILES

C1=CC=C(C=C1)SC2=CC=C(C=C2)C3=CC4=NC(=CC(=O)N4N3)CCl

InChI

InChI=1S/C19H14ClN3OS/c20-12-14-10-19(24)23-18(21-14)11-17(22-23)13-6-8-16(9-7-13)25-15-4-2-1-3-5-15/h1-11,22H,12H2