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

Systemtic Name: 3-(2-methoxyphenyl)-N-(3-methylsulfanylphenyl)-5-oxidanylidene-6,7-dihydro-1H-pyrazolo[1,5-a]pyrimidine-7-carboxamide Openeye Name: 3-(2-methoxyphenyl)-N-(3-methylsulfanylphenyl)-5-oxo-6,7-dihydro-1H-pyrazolo[1,5-a]pyrimidine-7-carboxamide CAS Name: 3-(2-methoxyphenyl)-N-[3-(methylthio)phenyl]-5-oxo-6,7-dihydro-1H-pyrazolo[1,5-a]pyrimidine-7-carboxamide IUPAC Name: 3-(2-methoxyphenyl)-N-(3-methylsulfanylphenyl)-5-oxo-6,7-dihydro-1H-pyrazolo[1,5-a]pyrimidine-7-carboxamide Traditional Name: 5-keto-3-(2-methoxyphenyl)-N-[3-(methylthio)phenyl]-6,7-dihydro-1H-pyrazolo[1,5-a]pyrimidine-7-carboxamide Formula: C21H20N4O3S MolecularWeight: 408.4735

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C2=CNN3C2=NC(=O)CC3C(=O)NC4=CC(=CC=C4)SC

Isomeric SMILES

COC1=CC=CC=C1C2=CNN3C2=NC(=O)CC3C(=O)NC4=CC(=CC=C4)SC

InChI

InChI=1S/C21H20N4O3S/c1-28-18-9-4-3-8-15(18)16-12-22-25-17(11-19(26)24-20(16)25)21(27)23-13-6-5-7-14(10-13)29-2/h3-10,12,17,22H,11H2,1-2H3,(H,23,27)