5-butylsulfanyl-3-(2-chlorophenyl)-1-methyl-1,2,4-triazole

Systemtic Name: 5-butylsulfanyl-3-(2-chlorophenyl)-1-methyl-1,2,4-triazole Openeye Name: 5-butylsulfanyl-3-(2-chlorophenyl)-1-methyl-1,2,4-triazole CAS Name: 5-(butylthio)-3-(2-chlorophenyl)-1-methyl-1,2,4-triazole IUPAC Name: 5-butylsulfanyl-3-(2-chlorophenyl)-1-methyl-1,2,4-triazole Traditional Name: 5-(butylthio)-3-(2-chlorophenyl)-1-methyl-1,2,4-triazole Formula: C13H16ClN3S MolecularWeight: 281.80424

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSC1=NC(=NN1C)C2=CC=CC=C2Cl

Isomeric SMILES

CCCCSC1=NC(=NN1C)C2=CC=CC=C2Cl

InChI

InChI=1S/C13H16ClN3S/c1-3-4-9-18-13-15-12(16-17(13)2)10-7-5-6-8-11(10)14/h5-8H,3-4,9H2,1-2H3