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

Systemtic Name: N-(3-methylsulfanylphenyl)-5-oxidanylidene-2-phenyl-6,7-dihydro-1H-pyrazolo[1,5-a]pyrimidine-7-carboxamide Openeye Name: N-(3-methylsulfanylphenyl)-5-oxo-2-phenyl-6,7-dihydro-1H-pyrazolo[1,5-a]pyrimidine-7-carboxamide CAS Name: N-[3-(methylthio)phenyl]-5-oxo-2-phenyl-6,7-dihydro-1H-pyrazolo[1,5-a]pyrimidine-7-carboxamide IUPAC Name: N-(3-methylsulfanylphenyl)-5-oxo-2-phenyl-6,7-dihydro-1H-pyrazolo[1,5-a]pyrimidine-7-carboxamide Traditional Name: 5-keto-N-[3-(methylthio)phenyl]-2-phenyl-6,7-dihydro-1H-pyrazolo[1,5-a]pyrimidine-7-carboxamide Formula: C20H18N4O2S MolecularWeight: 378.44752

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H18N4O2S/c1-27-15-9-5-8-14(10-15)21-20(26)17-12-19(25)22-18-11-16(23-24(17)18)13-6-3-2-4-7-13/h2-11,17,23H,12H2,1H3,(H,21,26)