ethyl 1-(2-cyanoethyl)-5-[ethoxy(propylsulfanyl)phosphinothioyl]oxy-pyrazole-3-carboxylate

Systemtic Name: ethyl 1-(2-cyanoethyl)-5-[ethoxy(propylsulfanyl)phosphinothioyl]oxy-pyrazole-3-carboxylate Openeye Name: ethyl 1-(2-cyanoethyl)-5-[ethoxy(propylsulfanyl)phosphinothioyl]oxy-pyrazole-3-carboxylate CAS Name: 1-(2-cyanoethyl)-5-[ethoxy-(propylthio)phosphinothioyl]oxy-3-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(2-cyanoethyl)-5-[ethoxy(propylsulfanyl)phosphinothioyl]oxypyrazole-3-carboxylate Traditional Name: 1-(2-cyanoethyl)-5-[ethoxy-(propylthio)thiophosphoryl]oxy-pyrazole-3-carboxylic acid ethyl ester Formula: C14H22N3O4PS2 MolecularWeight: 391.445941

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Descriptors Computed from Structure

Canonical SMILES:

CCCSP(=S)(OCC)OC1=CC(=NN1CCC#N)C(=O)OCC

Isomeric SMILES

CCCSP(=S)(OCC)OC1=CC(=NN1CCC#N)C(=O)OCC

InChI

InChI=1S/C14H22N3O4PS2/c1-4-10-24-22(23,20-6-3)21-13-11-12(14(18)19-5-2)16-17(13)9-7-8-15/h11H,4-7,9-10H2,1-3H3