3-[3-(4-chloranylphenoxy)propylsulfanyl]-4-methyl-1,2,4-triazole

Systemtic Name: 3-[3-(4-chloranylphenoxy)propylsulfanyl]-4-methyl-1,2,4-triazole Openeye Name: 3-[3-(4-chlorophenoxy)propylsulfanyl]-4-methyl-1,2,4-triazole CAS Name: 3-[3-(4-chlorophenoxy)propylthio]-4-methyl-1,2,4-triazole IUPAC Name: 3-[3-(4-chlorophenoxy)propylsulfanyl]-4-methyl-1,2,4-triazole Traditional Name: 3-[3-(4-chlorophenoxy)propylthio]-4-methyl-1,2,4-triazole Formula: C12H14ClN3OS MolecularWeight: 283.77706

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NN=C1SCCCOC2=CC=C(C=C2)Cl

Isomeric SMILES

CN1C=NN=C1SCCCOC2=CC=C(C=C2)Cl

InChI

InChI=1S/C12H14ClN3OS/c1-16-9-14-15-12(16)18-8-2-7-17-11-5-3-10(13)4-6-11/h3-6,9H,2,7-8H2,1H3