ethyl 5-oxidanylidene-7-(pyridin-2-ylsulfanylmethyl)-1H-pyrazolo[1,5-a]pyrimidine-3-carboxylate

Systemtic Name: ethyl 5-oxidanylidene-7-(pyridin-2-ylsulfanylmethyl)-1H-pyrazolo[1,5-a]pyrimidine-3-carboxylate Openeye Name: ethyl 5-oxo-7-(2-pyridylsulfanylmethyl)-1H-pyrazolo[1,5-a]pyrimidine-3-carboxylate CAS Name: 5-oxo-7-[(2-pyridinylthio)methyl]-1H-pyrazolo[1,5-a]pyrimidine-3-carboxylic acid ethyl ester IUPAC Name: ethyl 5-oxo-7-(pyridin-2-ylsulfanylmethyl)-1H-pyrazolo[1,5-a]pyrimidine-3-carboxylate Traditional Name: 5-keto-7-[(2-pyridylthio)methyl]-1H-pyrazolo[1,5-a]pyrimidine-3-carboxylic acid ethyl ester Formula: C15H14N4O3S MolecularWeight: 330.36166

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CNN2C1=NC(=O)C=C2CSC3=CC=CC=N3

Isomeric SMILES

CCOC(=O)C1=CNN2C1=NC(=O)C=C2CSC3=CC=CC=N3

InChI

InChI=1S/C15H14N4O3S/c1-2-22-15(21)11-8-17-19-10(7-12(20)18-14(11)19)9-23-13-5-3-4-6-16-13/h3-8,17H,2,9H2,1H3