ethyl 5-ethyl-2-[(4-nitrophenyl)methylsulfanyl]pyrazolo[1,5-a]pyridine-3-carboxylate

Systemtic Name: ethyl 5-ethyl-2-[(4-nitrophenyl)methylsulfanyl]pyrazolo[1,5-a]pyridine-3-carboxylate Openeye Name: ethyl 5-ethyl-2-[(4-nitrophenyl)methylsulfanyl]pyrazolo[1,5-a]pyridine-3-carboxylate CAS Name: 5-ethyl-2-[(4-nitrophenyl)methylthio]-3-pyrazolo[1,5-a]pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 5-ethyl-2-[(4-nitrophenyl)methylsulfanyl]pyrazolo[1,5-a]pyridine-3-carboxylate Traditional Name: 5-ethyl-2-[(4-nitrobenzyl)thio]pyrazolo[1,5-a]pyridine-3-carboxylic acid ethyl ester Formula: C19H19N3O4S MolecularWeight: 385.43686

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C(=NN2C=C1)SCC3=CC=C(C=C3)[N+](=O)[O-])C(=O)OCC

Isomeric SMILES

CCC1=CC2=C(C(=NN2C=C1)SCC3=CC=C(C=C3)[N+](=O)[O-])C(=O)OCC

InChI

InChI=1S/C19H19N3O4S/c1-3-13-9-10-21-16(11-13)17(19(23)26-4-2)18(20-21)27-12-14-5-7-15(8-6-14)22(24)25/h5-11H,3-4,12H2,1-2H3