3-[2-(4-bromanylphenoxy)ethylsulfanyl]-5-cyclopropyl-4-phenyl-1,2,4-triazole

Systemtic Name: 3-[2-(4-bromanylphenoxy)ethylsulfanyl]-5-cyclopropyl-4-phenyl-1,2,4-triazole Openeye Name: 3-[2-(4-bromophenoxy)ethylsulfanyl]-5-cyclopropyl-4-phenyl-1,2,4-triazole CAS Name: 3-[2-(4-bromophenoxy)ethylthio]-5-cyclopropyl-4-phenyl-1,2,4-triazole IUPAC Name: 3-[2-(4-bromophenoxy)ethylsulfanyl]-5-cyclopropyl-4-phenyl-1,2,4-triazole Traditional Name: 3-[2-(4-bromophenoxy)ethylthio]-5-cyclopropyl-4-phenyl-1,2,4-triazole Formula: C19H18BrN3OS MolecularWeight: 416.33472

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=NN=C(N2C3=CC=CC=C3)SCCOC4=CC=C(C=C4)Br

Isomeric SMILES

C1CC1C2=NN=C(N2C3=CC=CC=C3)SCCOC4=CC=C(C=C4)Br

InChI

InChI=1S/C19H18BrN3OS/c20-15-8-10-17(11-9-15)24-12-13-25-19-22-21-18(14-6-7-14)23(19)16-4-2-1-3-5-16/h1-5,8-11,14H,6-7,12-13H2