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

Systemtic Name: 2-(4-methoxyphenyl)-N-(3-methylsulfanylphenyl)-5-oxidanylidene-6,7-dihydro-1H-pyrazolo[1,5-a]pyrimidine-7-carboxamide Openeye Name: 2-(4-methoxyphenyl)-N-(3-methylsulfanylphenyl)-5-oxo-6,7-dihydro-1H-pyrazolo[1,5-a]pyrimidine-7-carboxamide CAS Name: 2-(4-methoxyphenyl)-N-[3-(methylthio)phenyl]-5-oxo-6,7-dihydro-1H-pyrazolo[1,5-a]pyrimidine-7-carboxamide IUPAC Name: 2-(4-methoxyphenyl)-N-(3-methylsulfanylphenyl)-5-oxo-6,7-dihydro-1H-pyrazolo[1,5-a]pyrimidine-7-carboxamide Traditional Name: 5-keto-2-(4-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=C(C=C1)C2=CC3=NC(=O)CC(N3N2)C(=O)NC4=CC(=CC=C4)SC

Isomeric SMILES

COC1=CC=C(C=C1)C2=CC3=NC(=O)CC(N3N2)C(=O)NC4=CC(=CC=C4)SC

InChI

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