3-bis(ethoxysulfanyl)phosphoryloxy-5-[(4-chlorophenyl)methylsulfanyl]-1,2,4-thiadiazole

Systemtic Name: 3-bis(ethoxysulfanyl)phosphoryloxy-5-[(4-chlorophenyl)methylsulfanyl]-1,2,4-thiadiazole Openeye Name: 3-bis(ethoxysulfanyl)phosphoryloxy-5-[(4-chlorophenyl)methylsulfanyl]-1,2,4-thiadiazole CAS Name: 3-bis(ethoxythio)phosphoryloxy-5-[(4-chlorophenyl)methylthio]-1,2,4-thiadiazole IUPAC Name: 3-bis(ethoxysulfanyl)phosphoryloxy-5-[(4-chlorophenyl)methylsulfanyl]-1,2,4-thiadiazole Traditional Name: 3-bis(ethoxythio)phosphoryloxy-5-[(4-chlorobenzyl)thio]-1,2,4-thiadiazole Formula: C13H16ClN2O4PS4 MolecularWeight: 458.963901

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Descriptors Computed from Structure

Canonical SMILES:

CCOSP(=O)(OC1=NSC(=N1)SCC2=CC=C(C=C2)Cl)SOCC

Isomeric SMILES

CCOSP(=O)(OC1=NSC(=N1)SCC2=CC=C(C=C2)Cl)SOCC

InChI

InChI=1S/C13H16ClN2O4PS4/c1-3-18-24-21(17,25-19-4-2)20-12-15-13(23-16-12)22-9-10-5-7-11(14)8-6-10/h5-8H,3-4,9H2,1-2H3