5-octylsulfanyl-3-phenyl-1,2,4-thiadiazole

Systemtic Name: 5-octylsulfanyl-3-phenyl-1,2,4-thiadiazole Openeye Name: 5-octylsulfanyl-3-phenyl-1,2,4-thiadiazole CAS Name: 5-(octylthio)-3-phenyl-1,2,4-thiadiazole IUPAC Name: 5-octylsulfanyl-3-phenyl-1,2,4-thiadiazole Traditional Name: 5-(octylthio)-3-phenyl-1,2,4-thiadiazole Formula: C16H22N2S2 MolecularWeight: 306.48928

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCSC1=NC(=NS1)C2=CC=CC=C2

Isomeric SMILES

CCCCCCCCSC1=NC(=NS1)C2=CC=CC=C2

InChI

InChI=1S/C16H22N2S2/c1-2-3-4-5-6-10-13-19-16-17-15(18-20-16)14-11-8-7-9-12-14/h7-9,11-12H,2-6,10,13H2,1H3