ethyl 4,6-dimethyl-2-phenacylsulfanyl-pyrazolo[1,5-a]pyridine-3-carboxylate

Systemtic Name: ethyl 4,6-dimethyl-2-phenacylsulfanyl-pyrazolo[1,5-a]pyridine-3-carboxylate Openeye Name: ethyl 4,6-dimethyl-2-phenacylsulfanyl-pyrazolo[1,5-a]pyridine-3-carboxylate CAS Name: 4,6-dimethyl-2-(phenacylthio)-3-pyrazolo[1,5-a]pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 4,6-dimethyl-2-phenacylsulfanylpyrazolo[1,5-a]pyridine-3-carboxylate Traditional Name: 4,6-dimethyl-2-(phenacylthio)pyrazolo[1,5-a]pyridine-3-carboxylic acid ethyl ester Formula: C20H20N2O3S MolecularWeight: 368.4494

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C2C(=CC(=CN2N=C1SCC(=O)C3=CC=CC=C3)C)C

Isomeric SMILES

CCOC(=O)C1=C2C(=CC(=CN2N=C1SCC(=O)C3=CC=CC=C3)C)C

InChI

InChI=1S/C20H20N2O3S/c1-4-25-20(24)17-18-14(3)10-13(2)11-22(18)21-19(17)26-12-16(23)15-8-6-5-7-9-15/h5-11H,4,12H2,1-3H3