[1-oxidanylidene-1-(3-oxidanylidene-2,4-dihydroquinoxalin-1-yl)propan-2-yl] 7-thiophen-2-ylpyrazolo[1,5-a]pyrimidine-3-carboxylate

Systemtic Name: [1-oxidanylidene-1-(3-oxidanylidene-2,4-dihydroquinoxalin-1-yl)propan-2-yl] 7-thiophen-2-ylpyrazolo[1,5-a]pyrimidine-3-carboxylate Openeye Name: [1-methyl-2-oxo-2-(3-oxo-2,4-dihydroquinoxalin-1-yl)ethyl] 7-(2-thienyl)pyrazolo[1,5-a]pyrimidine-3-carboxylate CAS Name: 7-thiophen-2-yl-3-pyrazolo[1,5-a]pyrimidinecarboxylic acid [1-oxo-1-(3-oxo-2,4-dihydroquinoxalin-1-yl)propan-2-yl] ester IUPAC Name: [1-oxo-1-(3-oxo-2,4-dihydroquinoxalin-1-yl)propan-2-yl] 7-thiophen-2-ylpyrazolo[1,5-a]pyrimidine-3-carboxylate Traditional Name: 7-(2-thienyl)pyrazolo[1,5-a]pyrimidine-3-carboxylic acid [2-keto-2-(3-keto-2,4-dihydroquinoxalin-1-yl)-1-methyl-ethyl] ester Formula: C22H17N5O4S MolecularWeight: 447.46648

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CC(=O)NC2=CC=CC=C21)OC(=O)C3=C4N=CC=C(N4N=C3)C5=CC=CS5

Isomeric SMILES

CC(C(=O)N1CC(=O)NC2=CC=CC=C21)OC(=O)C3=C4N=CC=C(N4N=C3)C5=CC=CS5

InChI

InChI=1S/C22H17N5O4S/c1-13(21(29)26-12-19(28)25-15-5-2-3-6-16(15)26)31-22(30)14-11-24-27-17(8-9-23-20(14)27)18-7-4-10-32-18/h2-11,13H,12H2,1H3,(H,25,28)