N-(4-methylphenyl)-2-methylsulfanyl-5-oxidanylidene-7-phenyl-1H-pyrazolo[1,5-a]pyrimidine-3-carboxamide

Systemtic Name: N-(4-methylphenyl)-2-methylsulfanyl-5-oxidanylidene-7-phenyl-1H-pyrazolo[1,5-a]pyrimidine-3-carboxamide Openeye Name: 2-methylsulfanyl-5-oxo-7-phenyl-N-(p-tolyl)-1H-pyrazolo[1,5-a]pyrimidine-3-carboxamide CAS Name: N-(4-methylphenyl)-2-(methylthio)-5-oxo-7-phenyl-1H-pyrazolo[1,5-a]pyrimidine-3-carboxamide IUPAC Name: N-(4-methylphenyl)-2-methylsulfanyl-5-oxo-7-phenyl-1H-pyrazolo[1,5-a]pyrimidine-3-carboxamide Traditional Name: 5-keto-2-(methylthio)-7-phenyl-N-(p-tolyl)-1H-pyrazolo[1,5-a]pyrimidine-3-carboxamide Formula: C21H18N4O2S MolecularWeight: 390.45822

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)C2=C(NN3C2=NC(=O)C=C3C4=CC=CC=C4)SC

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)C2=C(NN3C2=NC(=O)C=C3C4=CC=CC=C4)SC

InChI

InChI=1S/C21H18N4O2S/c1-13-8-10-15(11-9-13)22-20(27)18-19-23-17(26)12-16(14-6-4-3-5-7-14)25(19)24-21(18)28-2/h3-12,24H,1-2H3,(H,22,27)