5-(2-chlorophenyl)-3-decylsulfanyl-1H-1,2,4-triazole

Systemtic Name: 5-(2-chlorophenyl)-3-decylsulfanyl-1H-1,2,4-triazole Openeye Name: 5-(2-chlorophenyl)-3-decylsulfanyl-1H-1,2,4-triazole CAS Name: 5-(2-chlorophenyl)-3-(decylthio)-1H-1,2,4-triazole IUPAC Name: 5-(2-chlorophenyl)-3-decylsulfanyl-1H-1,2,4-triazole Traditional Name: 5-(2-chlorophenyl)-3-(decylthio)-1H-1,2,4-triazole Formula: C18H26ClN3S MolecularWeight: 351.93714

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCSC1=NNC(=N1)C2=CC=CC=C2Cl

Isomeric SMILES

CCCCCCCCCCSC1=NNC(=N1)C2=CC=CC=C2Cl

InChI

InChI=1S/C18H26ClN3S/c1-2-3-4-5-6-7-8-11-14-23-18-20-17(21-22-18)15-12-9-10-13-16(15)19/h9-10,12-13H,2-8,11,14H2,1H3,(H,20,21,22)