2-(4-fluorophenyl)-N-(3-methylsulfanylphenyl)-5-oxidanylidene-6,7-dihydro-1H-pyrazolo[1,5-a]pyrimidine-7-carboxamide

Systemtic Name: 2-(4-fluorophenyl)-N-(3-methylsulfanylphenyl)-5-oxidanylidene-6,7-dihydro-1H-pyrazolo[1,5-a]pyrimidine-7-carboxamide Openeye Name: 2-(4-fluorophenyl)-N-(3-methylsulfanylphenyl)-5-oxo-6,7-dihydro-1H-pyrazolo[1,5-a]pyrimidine-7-carboxamide CAS Name: 2-(4-fluorophenyl)-N-[3-(methylthio)phenyl]-5-oxo-6,7-dihydro-1H-pyrazolo[1,5-a]pyrimidine-7-carboxamide IUPAC Name: 2-(4-fluorophenyl)-N-(3-methylsulfanylphenyl)-5-oxo-6,7-dihydro-1H-pyrazolo[1,5-a]pyrimidine-7-carboxamide Traditional Name: 2-(4-fluorophenyl)-5-keto-N-[3-(methylthio)phenyl]-6,7-dihydro-1H-pyrazolo[1,5-a]pyrimidine-7-carboxamide Formula: C20H17FN4O2S MolecularWeight: 396.437983

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC(=C1)NC(=O)C2CC(=O)N=C3N2NC(=C3)C4=CC=C(C=C4)F

Isomeric SMILES

CSC1=CC=CC(=C1)NC(=O)C2CC(=O)N=C3N2NC(=C3)C4=CC=C(C=C4)F

InChI

InChI=1S/C20H17FN4O2S/c1-28-15-4-2-3-14(9-15)22-20(27)17-11-19(26)23-18-10-16(24-25(17)18)12-5-7-13(21)8-6-12/h2-10,17,24H,11H2,1H3,(H,22,27)